SitesBLAST

LAAG 11:14 (= LAAG 8:11) binding UDP-N-acetyl-alpha-D-glucosamine
K25 (= K22) mutation to A: No pyrophosphorylase activity.
Q76 (= Q73) binding UDP-N-acetyl-alpha-D-glucosamine; mutation to A: No pyrophosphorylase activity.
GT 81:82 (= GT 78:79) binding UDP-N-acetyl-alpha-D-glucosamine
Y103 (= Y100) mutation to A: Reduces the pyrophosphorylase activity.
YGD 103:105 (= YGD 100:102) binding UDP-N-acetyl-alpha-D-glucosamine
D105 (= D102) mutation to A: No pyrophosphorylase activity.
G140 (= G137) binding UDP-N-acetyl-alpha-D-glucosamine
E154 (= E152) binding UDP-N-acetyl-alpha-D-glucosamine
N169 (= N167) binding UDP-N-acetyl-alpha-D-glucosamine
V223 (= V221) mutation to A: Reduces slightly the pyrophosphorylase activity.
E224 (≠ L222) mutation to A: Reduces the pyrophosphorylase activity.

Q8Z9S7 Bifunctional protein GlmU; EC 2.7.7.23; EC 2.3.1.157 from Yersinia pestis
53% identity, 99% coverage: 3:455/456 of query aligns to 6:456/456 of Q8Z9S7

query
sites
Q8Z9S7

I

M

T

S

T

V

I

V

I

I

L

L

A

A

G

G

K

K

G

G

T

T

R

R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

P

I

L

A

A

G

G

K

K

P

P

L

M

L

V

K

Q

H

H

V

V

Y

I

D

D

M

A

C

A

S

M

E

K

L

L

Q

G

N

A

N

Q

R

H

I

V

K

H

I

L

I

V

Y

Y

G

G

H

H

G

G

A

G

E

E

Q

L

V

L

L

K

E

K

V

T

L

L

K

A

D

D

L

P

D

S

A

L

D

N

W

W

I

V

E

L

Q

Q

K

A

Q

E

Q

Q

L

L

G

G

T

T

G

G

H

H

A

A

V

M

Q

Q

V

A

K

A

D

P

Q

H

I

F

N

A

P

D

A

D

D

E

I

D

V

I

L

L

I

M

L

L

Y

Y

G

G

D

D

V

V

P

P

L

L

L

I

K

S

L

V

G

D

T

T

V

L

K

Q

H

R

L

L

I

L

A

A

E

A

V

K

S

P

D

E

K

G

S

G

L

I

A

G

L

L

T

T

V

V

N

K

L

L

E

D

N

N

P

P

R

S

G

G

Y

Y

G

G

R

R

I

I

V

V

R

R

N

-

D

E

H

N

G

G

A

D

V

V

T

V

R

G

I

I

V

V

E

E

E

H

K

K

D

D

A

A

S

S

E

D

S

A

E

Q

V

R

L

E

I

I

R

N

E

E

V

I

N

N

T

T

G

G

I

I

M

L

A

V

V

A

Q

N

G

G

G

R

H

D

L

L

I

K

K

R

W

W

L

L

D

S

R

L

L

L

N

D

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

F

Y

Y

L

I

T

T

D

D

I

I

E

A

M

L

A

A

V

H

A

A

D

D

H

G

V

K

H

K

I

I

A

A

T

T

S

V

Q

H

P

P

K

T

T

R

I

L

D

S

E

E

V

V

L

E

G

G

V

V

N

N

R

R

S

L

Q

Q

L

L

G

S

H

A

L

L

E

E

R

R

V

V

H

F

Q

Q

L

T

E

E

Q

Q

A

A

Q

E

Q

K

L

L

M

L

E

L

R

A

G

G

V

V

T

M

L

L

Y

L

D

D

P

P

V

S

R

R

F

F

D

D

L

L

R

R

G

G

T

E

I

L

E

T

H

H

L

-

G

G

L

R

D

D

I

I

E

T

I

I

D

D

V

T

N

N

V

V

I

I

L

I

E

E

G

G

Q

H

I

V

S

I

I

L

G

G

N

D

N

R

V

V

R

R

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

C

V

V

I

I

E

G

D

D

N

D

A

S

E

E

I

I

L

S

D

P

H

Y

S

T

L

V

I

L

E

E

K

D

A

A

V

R

V

L

G

D

Q

A

G

N

S

C

R

T

I

V

G

G

P

P

F

F

A

A

R

R

L

L

R
|
R

P

P

E

G

T

A

V

E

I

L

A

A

R

E

N

G

V

A

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K
|
K

K

K

S

A

S

R

V

L

A

G

D

K

G

G

S

S

K

K

I

A

N

G

H

H

L

L

S

S

Y
|
Y

I

L

G

G

D

D

C

A

T

E

V

I

G

G

S

A

R

G

V

V

N
|
N

V

I

G

G

A

A

G

G

T

T

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

T

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

V

T

T

K

R

D

D

S

V

P

A

E

E

N

N

Q

E

L

L

T

V

L

I

S

S

R

R

A

V

K

K

Q

Q

V

V

S

H

I

I

N

Q

G

G

W

W

Q

K

R

R

P

P

S

V

K

K

R

K

E

K

R333 (= R332) binding UDP-N-acetyl-alpha-D-glucosamine
K351 (= K350) binding UDP-N-acetyl-alpha-D-glucosamine
Y366 (= Y365) binding UDP-N-acetyl-alpha-D-glucosamine
N377 (= N376) binding UDP-N-acetyl-alpha-D-glucosamine

4kqlA Hin glmu bound to wg578 (see paper)
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 4kqlA

query
sites
4kqlA

I

L

T

S

T

A

I

V

I

I

L

L

A
|
A

G

G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q
|
Q

K

T

Q

E

Q
|
Q

L

L

G
|
G

T
|
T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y
|
Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y
|
Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N

N

T
|
T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V
|
V

L

E

G
|
G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding N-(4-{[3-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-5-methoxybenzoyl]amino}phenyl)pyridine-2-carboxamide: A9 (= A9), A10 (= A10), Q73 (= Q73), Q76 (= Q76), G78 (= G78), T79 (= T79), Y100 (= Y100), D102 (= D102), Y136 (= Y136), T167 (= T168), V220 (= V221), G222 (= G223)

4kpzA Hin glmu bound to a small molecule fragment (see paper)
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 4kpzA

query
sites
4kpzA

I

L

T

S

T

A

I

V

I

I

L
|
L

A
|
A

G
|
G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V
|
V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q
|
Q

K

T

Q

E

Q
|
Q

L

L

G
|
G

T

T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y

Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y

Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N

N

T

T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V

V

L

E

G

G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding 1-(3-nitrophenyl)dihydropyrimidine-2,4(1H,3H)-dione: L8 (= L8), A9 (= A9), A10 (= A10), G11 (= G11), V23 (= V23), Q73 (= Q73), Q76 (= Q76), G78 (= G78), D102 (= D102)

4kpxA Hin glmu bound to wg766 (see paper)
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 4kpxA

query
sites
4kpxA

I

L

T

S

T

A

I

V

I

I

L
|
L

A
|
A

G
|
G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q

Q

K

T

Q

E

Q

Q

L

L

G

G

T

T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y
|
Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y
|
Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N

N

T
|
T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V
|
V

L

E

G
|
G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding N-{4-[(4-hydroxy-3-nitrobenzoyl)amino]phenyl}pyridine-2-carboxamide: L8 (= L8), A9 (= A9), A10 (= A10), G11 (= G11), Y100 (= Y100), D102 (= D102), Y136 (= Y136), T167 (= T168), V220 (= V221), G222 (= G223)

4knxA Hin glmu bound to wg176 (see paper)
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 4knxA

query
sites
4knxA

I

L

T

S

T

A

I

V

I

I

L
|
L

A

A

A
|
A

G
|
G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q
|
Q

K

T

Q

E

Q
|
Q

L

L

G

G

T
|
T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y
|
Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y
|
Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N

N

T
|
T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V
|
V

L

E

G
|
G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding [(4-{[4-(benzoylamino)phenyl]amino}-6-methoxyquinazolin-7-yl)oxy]acetic acid: L8 (= L8), A10 (= A10), G11 (= G11), Q73 (= Q73), Q76 (= Q76), T79 (= T79), Y100 (= Y100), D102 (= D102), Y136 (= Y136), T167 (= T168), V220 (= V221), G222 (= G223)

4knrA Hin glmu bound to wg188 (see paper)
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 4knrA

query
sites
4knrA

I

L

T

S

T

A

I

V

I

I

L
|
L

A
|
A

G
|
G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q

Q

K

T

Q

E

Q

Q

L

L

G

G

T
|
T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y
|
Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y
|
Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N

N

T

T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V
|
V

L

E

G

G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding N-{4-[(2-benzyl-7-hydroxy-6-methoxyquinazolin-4-yl)amino]phenyl}benzamide: L8 (= L8), A9 (= A9), A10 (= A10), G11 (= G11), T79 (= T79), Y100 (= Y100), D102 (= D102), Y136 (= Y136), V220 (= V221)

4e1kA Glmu in complex with a quinazoline compound (see paper)
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 4e1kA

query
sites
4e1kA

I

L

T

S

T

A

I

V

I

I

L
|
L

A
|
A

G
|
G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q

Q

K

T

Q

E

Q

Q

L

L

G

G

T
|
T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y
|
Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y
|
Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N

N

T

T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V
|
V

L
x
E

G

G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding N-{4-[(7-hydroxy-6-methoxyquinazolin-4-yl)amino]phenyl}benzamide: L8 (= L8), A9 (= A9), A10 (= A10), G11 (= G11), T79 (= T79), Y100 (= Y100), D102 (= D102), Y136 (= Y136), V220 (= V221), E221 (≠ L222)

2w0wA Crystal structure of glmu from haemophilus influenzae in complex with quinazoline inhibitor 2
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 2w0wA

query
sites
2w0wA

I

L

T

S

T

A

I

V

I

I

L
|
L

A

A

G
|
G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q
|
Q

K

T

Q

E

Q

Q

L

L

G

G

T
|
T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y
|
Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y
|
Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N
|
N

T
|
T

G
|
G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V
|
V

L

E

G
|
G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P
|
P

active site: R15 (= R15)
binding n-{6-(cyclopropylmethoxy)-7-methoxy-2-[6-(2-methylpropyl)-5-oxo-3,4,5,6-tetrahydro-2,6-naphthyridin-2(1h)-yl]quinazolin-4-yl}-2,2,2-trifluoroethanesulfonamide: L8 (= L8), G11 (= G11), Q73 (= Q73), T79 (= T79), Y100 (= Y100), D102 (= D102), Y136 (= Y136), N166 (= N167), T167 (= T168), G168 (= G169), V220 (= V221), G222 (= G223), P449 (= P451)

Sites not aligning to the query:

binding n-{6-(cyclopropylmethoxy)-7-methoxy-2-[6-(2-methylpropyl)-5-oxo-3,4,5,6-tetrahydro-2,6-naphthyridin-2(1h)-yl]quinazolin-4-yl}-2,2,2-trifluoroethanesulfonamide: 450

2w0vA Crystal structure of glmu from haemophilus influenzae in complex with quinazoline inhibitor 1
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 2w0vA

query
sites
2w0vA

I

L

T

S

T

A

I

V

I

I

L
|
L

A

A

G
|
G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q

Q

K

T

Q

E

Q

Q

L

L

G

G

T

T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y
|
Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V
|
V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y

Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N

N

T
|
T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V
|
V

L

E

G
|
G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding 6-(cycloprop-2-en-1-ylmethoxy)-2-[6-(cyclopropylmethyl)-5-oxo-3,4,5,6-tetrahydro-2,6-naphthyridin-2(1h)-yl]-7-methoxyquinazolin-4(3h)-one: L8 (= L8), G11 (= G11), Y100 (= Y100), D102 (= D102), V128 (= V128), T167 (= T168), V220 (= V221), G222 (= G223)

Sites not aligning to the query:

binding 6-(cycloprop-2-en-1-ylmethoxy)-2-[6-(cyclopropylmethyl)-5-oxo-3,4,5,6-tetrahydro-2,6-naphthyridin-2(1h)-yl]-7-methoxyquinazolin-4(3h)-one: 450

2vd4A Structure of small-molecule inhibitor of glmu from haemophilus influenzae reveals an allosteric binding site (see paper)
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 2vd4A

query
sites
2vd4A

I

L

T

S

T

A

I

V

I

I

L

L

A

A

G

G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q

Q

K

T

Q

E

Q

Q

L

L

G

G

T

T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y

Y

G

G

D

D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y
|
Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N

N

T

T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D
x
M

E

E

V
|
V

L
x
E

G

G

V

A

N

N

R

R

S

L

Q
|
Q

L

L

G

A

H

A

L
|
L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding 4-chloro-N-(3-methoxypropyl)-N-[(3S)-1-(2-phenylethyl)piperidin-3-yl]benzamide: Y136 (= Y136), M218 (≠ D219), V220 (= V221), E221 (≠ L222), Q228 (= Q229), L232 (= L233)

2v0lA Characterization of substrate binding and catalysis of the potential antibacterial target n-acetylglucosamine-1-phosphate uridyltransferase (glmu) (see paper)
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 2v0lA

query
sites
2v0lA

I

L

T

S

T

A

I

V

I

I

L

L

A

A

A
|
A

G

G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q
|
Q

K

T

Q

E

Q
|
Q

L

L

G
|
G

T
|
T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y
|
Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y

Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N

N

T

T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V

V

L

E

G

G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding uridine: A10 (= A10), Q73 (= Q73), Q76 (= Q76), G78 (= G78), T79 (= T79), Y100 (= Y100), D102 (= D102)

Sites not aligning to the query:

binding uridine: 450

2v0kA Characterization of substrate binding and catalysis of the potential antibacterial target n-acetylglucosamine-1-phosphate uridyltransferase (glmu) (see paper)
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 2v0kA

query
sites
2v0kA

I

L

T

S

T

A

I

V

I

I

L

L

A

A

A
|
A

G
|
G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q
|
Q

K

T

Q

E

Q
|
Q

L

L

G
|
G

T

T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y
|
Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y

Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N

N

T

T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V

V

L

E

G

G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding uridine-5'-diphosphate: A10 (= A10), G11 (= G11), Q73 (= Q73), Q76 (= Q76), G78 (= G78), Y100 (= Y100), D102 (= D102)

2v0iA Characterization of substrate binding and catalysis of the potential antibacterial target n-acetylglucosamine-1-phosphate uridyltransferase (glmu) (see paper)
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/450 of 2v0iA

query
sites
2v0iA

I

L

T

S

T

A

I

V

I

I

L

L

A

A

A
|
A

G

G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q
|
Q

K

T

Q

E

Q
|
Q

L

L

G
|
G

T
|
T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y

Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y
|
Y

G
|
G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E
|
E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N
|
N

T
|
T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

Y
|
Y

L

L

T
|
T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V

V

L

E

G

G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding uridine-diphosphate-n-acetylglucosamine: A10 (= A10), Q73 (= Q73), Q76 (= Q76), G78 (= G78), T79 (= T79), D102 (= D102), Y136 (= Y136), G137 (= G137), E151 (= E152), N166 (= N167), T167 (= T168), Y194 (= Y195), T196 (= T197)

Sites not aligning to the query:

binding uridine-diphosphate-n-acetylglucosamine: 450

2v0jA Characterization of substrate binding and catalysis of the potential antibacterial target n-acetylglucosamine-1-phosphate uridyltransferase (glmu) (see paper)
53% identity, 98% coverage: 3:451/456 of query aligns to 3:449/449 of 2v0jA

query
sites
2v0jA

I

L

T

S

T

A

I

V

I

I

L

L

A

A

A
|
A

G

G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

I

A

A

G

G

K

K

P

P

L

M

L

V

K

K

H

H

V

V

Y

I

D

D

M

T

C

A

S

H

E

Q

L

L

Q

G

N

S

N

E

R

N

I

I

K

H

I

L

I

I

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

M

L

R

E

T

V

H

L

L

K

A

D

N

L

E

D

Q

A

V

D

N

W

W

I

V

E

L

Q
|
Q

K

T

Q

E

Q
|
Q

L

L

G
|
G

T
|
T

G

A

H

H

A

A

V

V

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

K

P

D

A

N

D

E

I

N

V

I

L

V

I

V

L

L

Y
|
Y

G

G

D
|
D

V

A

P

P

L

L

L

I

K

T

L

K

G

E

T

T

V

L

K

E

H

K

L

L

I

I

A

E

E

A

V

K

S

P

D

E

K

N

S

G

L

I

A

A

L

L

T

T

V

V

N

N

L

L

E

D

N

N

P

P

R

T

G

G

Y

Y

G

G

R

R

I

I

V

I

R

R

N

-

D

E

H

N

G

G

A

N

V

V

T

V

R

A

I

I

V

V

E

E

E

Q

K

K

D

D

A

A

S

N

E

A

S

E

E

Q

V

L

L

N

I

I

R

K

E

E

V

V

N

N

T

T

G

G

I

V

M

M

A

V

V

S

Q

D

G

G

G

A

H

S

L

F

I

K

K

K

W

W

L

L

D

A

R

R

L

V

N

G

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

L

T

T

D

D

I

L

I

I

E

A

M

L

A

A

V

N

A

Q

D

D

H

N

V

C

H

Q

I

V

A

V

T

A

S

V

Q

Q

P

A

K

T

T

D

I

V

D

M

E

E

V

V

L

E

G

G

V

A

N

N

R

R

S

L

Q

Q

L

L

G

A

H

A

L

L

E

E

R

R

V

Y

H

F

Q

Q

L

N

E

K

Q

Q

A

A

Q

S

Q

K

L

L

M

L

E

L

R

E

G

G

V

V

T

M

L

I

Y

Y

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

E

H

H

L

-

G

G

L

K

D

D

I

V

E

E

I

I

D

D

V

V

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

K

I

L

G

G

N

D

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

V

V

V

I

I

E

G

D

N

N

D

A

V

E

E

I

I

L

K

D

P

H

Y

S

S

L

V

I

L

E

E

K

D

A

S

V

I

V

V

G

G

Q

E

G

K

S

A

R

A

I

I

G

G

P

P

F

F

A

S

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

A

R

A

N

E

V

T

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K

K

S

S

S

T

V

V

A

G

D

K

G

G

S

S

K

K

I

V

N

N

H

H

L

L

S

T

Y

Y

I

V

G

G

D

D

C

S

T

E

V

I

G

G

S

S

R

N

V

C

N

N

V

I

G

G

A

A

G

G

T

V

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

K

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

I

T

T

K

R

D

D

S

V

P

G

E

E

N

N

Q

E

L

L

T

V

L

I

S

T

R

R

A

V

K

A

Q

Q

V

R

S

H

I

I

N

Q

G

G

W

W

Q

Q

R

R

P

P

active site: R15 (= R15)
binding 5,6-dihydrouridine-5'-monophosphate: A10 (= A10), Q73 (= Q73), Q76 (= Q76), G78 (= G78), T79 (= T79), Y100 (= Y100), D102 (= D102)

4fceA Crystal structure of yersinia pestis glmu in complex with alpha-d- glucosamine 1-phosphate (gp1)
53% identity, 98% coverage: 2:448/456 of query aligns to 2:441/441 of 4fceA

query
sites
4fceA

K

S

I

M

T

S

T

V

I

V

I

I

L

L

A

A

G

G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

P

I

L

A

A

G

G

K

K

P

P

L

M

L

V

K

Q

H

H

V

V

Y

I

D

D

M

A

C

A

S

M

E

K

L

L

Q

G

N

A

N

Q

R

H

I

V

K

H

I

L

I

V

Y

Y

G

G

H

H

G

G

A

G

E

E

Q

L

V

L

L

K

E

K

V

T

L

L

K

-

D

-

L

-

D

-

A

-

D

N

W

W

I

V

E

L

Q

Q

K

A

Q

E

Q

Q

L

L

G

G

T

T

G

G

H

H

A

A

V

M

Q

Q

V

A

K

A

D

P

Q

H

I

F

N

A

P

D

A

D

D

E

I

D

V

I

L

L

I

M

L

L

Y

Y

G

G

D

D

V

V

P

P

L

L

L

I

K

S

L

V

G

D

T

T

V

L

K

Q

H

R

L

L

I

L

A

A

E

A

V

K

S

P

D

E

K

G

S

G

L

I

A

G

L

L

T

T

V

V

N

K

L

L

E

D

N

N

P

P

R

S

G

G

Y

Y

G

G

R

R

I

I

V

V

R

R

N

-

D

E

H

N

G

G

A

D

V

V

T

V

R

G

I

I

V

V

E

E

E

H

K

K

D

D

A

A

S

S

E

D

S

A

E

Q

V

R

L

E

I

I

R

N

E

E

V

I

N

N

T

T

G

G

I

I

M

L

A

V

V

A

Q

N

G

G

G

R

H

D

L

L

I

K

K

R

W

W

L

L

D

S

R

L

L

L

N

D

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

F

Y

Y

L

I

T

T

D

D

I

I

E

A

M

L

A

A

V

H

A

A

D

D

H

G

V

K

H

K

I

I

A

A

T

T

S

V

Q

H

P

P

K

T

T

R

I

L

D

S

E

E

V

V

L

E

G

G

V

V

N

N

R

R

S

L

Q

Q

L

L

G

S

H

A

L

L

E

E

R

R

V

V

H

F

Q

Q

L

T

E

E

Q

Q

A

A

Q

E

Q

K

L

L

M

L

E

L

R

A

G

G

V

V

T

M

L

L

Y

L

D

D

P

P

V

S

R

R

F

F

D

D

L

L

R

R

G

G

T

E

I

L

E

T

H

H

L

-

G

G

L

R

D

D

I

I

E

T

I

I

D

D

V

T

N

N

V

V

I

I

L

I

E

E

G

G

Q

H

I

V

S

I

I

L

G

G

N

D

N

R

V

V

R

R

I

I

G

G

A

T

N

G

C

C

R

V

I

L

V

K

D

N

S

C

V

V

I

I

E

G

D

D

N

D

A

S

E

E

I

I

L

S

D

P

H

Y

S

T

L

V

I

L

E

E

K

D

A

A

V

R

V

L

G

D

Q

A

G

N

S

C

R

T

I

V

G

G

P

P

F

F

A

A

R

R

L

L

R
|
R

P

P

E

G

T

A

V

E

I

L

A

A

R

E

N

G

V

A

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

I

K
|
K

K

K

S

A

S

R

V

L

A

G

D

K

G

G

S

S

K

K

I

A

N

G

H

H

L

L

S

S

Y
|
Y

I

L

G

G

D

D

C

A

T

E

V

I

G

G

S

A

R

G

V

V

N

N

V

I

G

G

A

A

G

G

T

T

I

I

T

T

C

C

N
|
N

Y
|
Y

D

D

G

G

V

A

N

N

K
|
K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G

G

S

S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

T

I

V

G

A

Q

N

N

G

A

A

T

T

I

I

G

G

A

A

G

G

S

T

T

T

I

V

T

T

K

R

D

D

S

V

P

A

E

E

N

N

Q

E

L

L

T

V

L

I

S

S

R

R

A

V

K

K

Q

Q

V

V

S

H

I

I

N

Q

G

G

W

W

active site: R15 (= R15)
binding 2-amino-2-deoxy-1-O-phosphono-alpha-D-glucopyranose: R325 (= R332), K343 (= K350), Y358 (= Y365), N378 (= N385), Y379 (= Y386), K384 (= K391)

P0ACC7 Bifunctional protein GlmU; EC 2.7.7.23; EC 2.3.1.157 from Escherichia coli (strain K12) (see 6 papers)
51% identity, 99% coverage: 3:455/456 of query aligns to 6:456/456 of P0ACC7

query
sites
P0ACC7

I
x
M

T
x
S

T
x
V

I
x
V

I
|
I

L
|
L

A
|
A

G
|
G

K
|
K

G
|
G

T
|
T

R
|
R

M
|
M

R
x
Y

S
|
S

E
x
D

L
|
L

P
|
P

K
|
K

V
|
V

L
|
L

H
|
H

K
x
T

I
x
L

A
|
A

G
|
G

K
|
K

P
x
A

L
x
M

L
x
V

K
x
Q

H
|
H

V
|
V

Y
x
I

D
|
D

M
x
A

C
x
A

S
x
N

E
|
E

L
|
L

Q
x
G

N
x
A

R
x
H

I
x
V

K
x
H

I
x
L

I
x
V

Y
|
Y

G
|
G

H
|
H

G
|
G

A
x
G

E
x
D

Q
x
L

V
x
L

L
x
K

E
x
Q

V
x
A

L
|
L

K
|
K

D
|
D

L
x
D

D
x
N

A
x
L

D
x
N

W
|
W

I
x
V

E
x
L

Q
|
Q

K
x
A

Q
x
E

Q
|
Q

L
|
L

G
|
G

T
|
T

G
|
G

H
|
H

A
|
A

V
x
M

Q
|
Q

V
x
A

K
x
A

D
x
P

Q
x
F

I
x
F

N
x
A

P
x
D

A
x
D

D
x
E

I
x
D

V
x
I

L
|
L

I
x
M

L
|
L

Y
|
Y

G
|
G

D
|
D

V
|
V

P
|
P

L
|
L

L
x
I

K
x
S

L
x
V

G
x
E

T
|
T

V
x
L

K
x
Q

H
x
R

L
|
L

I
x
R

A
x
D

E
x
A

V
x
K

S
x
P

D
x
Q

K
x
G

S
x
G

L
x
I

A
x
G

L
|
L

T
|
T

V
|
V

N
x
K

L
|
L

E
x
D

N
x
D

P
|
P

R
x
T

G
|
G

Y
|
Y

G
|
G

R
|
R

I
|
I

V
x
T

R
|
R

N

-

D
x
E

H
x
N

G
|
G

A
x
K

V
|
V

T
|
T

R
x
G

I
|
I

V
|
V

E
|
E

E
x
H

K
|
K

D
|
D

A
|
A

S
x
T

E
x
D

S
x
E

E
x
Q

V
x
R

L
x
Q

I
|
I

R
x
Q

E
|
E

V
x
I

N
|
N

T
|
T

G
|
G

I
|
I

M
x
L

A
x
I

V
x
A

Q
x
N

G
|
G

G
x
A

H
x
D

L
x
M

I
x
K

K
x
R

W
|
W

L
|
L

D
x
A

R
x
K

L
|
L

N
x
T

N
|
N

H
x
N

N
|
N

A
|
A

Q
|
Q

G
|
G

E
|
E

Y
|
Y

L
x
I

T
|
T

D
|
D

I
|
I

E
x
A

M
x
L

A
|
A

V
x
Y

A
x
Q

D
x
E

H
x
G

V
x
R

H
x
E

I
|
I

A
x
V

T
x
A

S
x
V

Q
x
H

P
|
P

K
x
Q

T
x
R

I
x
L

D
x
S

E
|
E

V
|
V

L
x
E

G
|
G

V
|
V

N
|
N

R
|
R

S
x
L

Q
|
Q

L
|
L

G
x
S

H
x
R

L
|
L

E
|
E

R
|
R

V
|
V

H
x
Y

Q
|
Q

L
x
S

E
|
E

Q
|
Q

A
|
A

Q
x
E

Q
x
K

L
|
L

M
x
L

E
x
L

R
x
A

G
|
G

V
|
V

T
x
M

L
|
L

Y
x
R

D
|
D

P
|
P

V
x
A

R
|
R

F
|
F

D
|
D

L
|
L

R
|
R

G
|
G

T
|
T

I
x
L

E
x
T

H
|
H

L

-

G
|
G

L
x
R

D
|
D

I
x
V

E
|
E

I
|
I

D
|
D

V
x
T

N
|
N

V
|
V

I
|
I

L
x
I

E
|
E

G
|
G

Q
x
N

I
x
V

S
x
T

I
x
L

G
|
G

N
x
H

N
x
R

V
|
V

R
x
K

I
|
I

G
|
G

A
x
T

N
x
G

C
|
C

R
x
V

I
|
I

V
x
K

D
x
N

S
|
S

V
|
V

I
|
I

E
x
G

D
|
D

N
x
D

A
x
C

E
|
E

I
|
I

L
x
S

D
x
P

H
x
Y

S
x
T

L
x
V

I
x
V

E
|
E

K
x
D

A
|
A

V
x
N

V
x
L

G
x
A

Q
x
A

G
x
A

S
x
C

R
x
T

I
|
I

G
|
G

P
|
P

F
|
F

A
|
A

R
|
R

L
|
L

R
|
R

P
|
P

E
x
G

T
x
A

V
x
E

I
x
L

A
x
L

R
x
E

N
x
G

V
x
A

H
|
H

I
x
V

G
|
G

N
|
N

F
|
F

V
|
V

E
|
E

I
x
M

K
|
K

S
x
A

S
x
R

V
x
L

A
x
G

D
x
K

G
|
G

S
|
S

K
|
K

I
x
A

N
x
G

H
|
H

L
|
L

S
x
T

Y
|
Y

I
x
L

G
|
G

D
|
D

C
x
A

T
x
E

V
x
I

G
|
G

S
x
D

R
x
N

V
|
V

N
|
N

V
x
I

G
|
G

A
|
A

G
|
G

T
|
T

I
|
I

T
|
T

C
|
C

N
|
N

Y
|
Y

D
|
D

G
|
G

V
x
A

N
|
N

K
|
K

F
|
F

H
x
K

T
|
T

V
x
I

I
|
I

G
|
G

D
|
D

G
x
D

A
x
V

F
|
F

I
x
V

G
|
G

S
|
S

D
|
D

T
|
T

Q
|
Q

L
|
L

I
x
V

A
|
A

P
|
P

V
|
V

T
|
T

I
x
V

G
|
G

Q
x
K

N
x
G

A
|
A

T
|
T

I
|
I

G
x
A

A
|
A

G
|
G

S
x
T

T
|
T

I
x
V

T
|
T

K
x
R

D
x
N

S
x
V

P
x
G

E
|
E

N
|
N

Q
x
A

L
|
L

T
x
A

L
x
I

S
|
S

R
|
R

A
x
V

K
x
P

Q
|
Q

V
x
T

S
x
Q

I
x
K

N
x
E

G
|
G

W
|
W

Q
x
R

R
|
R

P
|
P

S
x
V

K
|
K

R
x
K

E
x
K

LAAG 11:14 (= LAAG 8:11) binding UDP-N-acetyl-alpha-D-glucosamine
G14 (= G11) mutation to A: 8-fold decrease in uridyltransferase activity. Creates steric conflict and decreases affinity for UTP.
R18 (= R15) mutation to A: Dramatically impairs the uridyltransferase activity.
K25 (= K22) mutation to A: 8-fold decrease in uridyltransferase activity.
Q76 (= Q73) binding UDP-N-acetyl-alpha-D-glucosamine
GT 81:82 (= GT 78:79) binding UDP-N-acetyl-alpha-D-glucosamine
YGD 103:105 (= YGD 100:102) binding UDP-N-acetyl-alpha-D-glucosamine
D105 (= D102) binding Co(2+); binding Mg(2+)
G140 (= G137) binding UDP-N-acetyl-alpha-D-glucosamine
E154 (= E152) binding UDP-N-acetyl-alpha-D-glucosamine
N169 (= N167) binding UDP-N-acetyl-alpha-D-glucosamine
N227 (= N225) binding Co(2+); binding Mg(2+)
230:250 (vs. 228:248, 52% identical) Linker
251:456 (vs. 249:455, 55% identical) N-acetyltransferase
C296 (= C295) mutation to A: No effect.
C307 (≠ A306) mutation to A: 1350-fold decrease in acetyltransferase activity.
C324 (≠ S323) mutation to A: 8-fold decrease in acetyltransferase activity.
R333 (= R332) binding UDP-N-acetyl-alpha-D-glucosamine
K351 (= K350) binding UDP-N-acetyl-alpha-D-glucosamine
Y366 (= Y365) binding UDP-N-acetyl-alpha-D-glucosamine
N377 (= N376) binding UDP-N-acetyl-alpha-D-glucosamine
A380 (= A379) binding acetyl-CoA
C385 (= C384) mutation to A: No effect.
S405 (= S404) binding acetyl-CoA
A423 (= A422) binding acetyl-CoA
R440 (= R439) binding acetyl-CoA

Sites not aligning to the query:

1:229 Pyrophosphorylase

2oi6B E. Coli glmu- complex with udp-glcnac, coa and glcn-1-po4 (see paper)
51% identity, 99% coverage: 3:453/456 of query aligns to 4:452/452 of 2oi6B

query
sites
2oi6B

I

M

T

S

T

V

I

V

I

I

L
|
L

A
|
A

G
|
G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

L

A

A

G

G

K

K

P

A

L

M

L

V

K

Q

H

H

V

V

Y

I

D

D

M

A

C

A

S

N

E

E

L

L

Q

G

N

A

R

H

I

V

K

H

I

L

I

V

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

L

L

K

E

Q

V

A

L

L

K

K

D

D

L

D

D

N

A

L

D

N

W

W

I

V

E

L

Q
|
Q

K

A

Q

E

Q
|
Q

L

L

G
|
G

T
|
T

G

G

H

H

A

A

V

M

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

A

P

D

A

D

D

E

I

D

V

I

L

L

I

M

L

L

Y
|
Y

G

G

D
|
D

V

V

P

P

L

L

L

I

K

S

L

V

G

E

T

T

V

L

K

Q

H

R

L

L

I

R

A

D

E

A

V

K

S

P

D

Q

K

G

S

G

L

I

A

G

L

L

T

T

V

V

N

K

L

L

E

D

N

D

P

P

R

T

G

G

Y
|
Y

G
|
G

R

R

I

I

V

T

R

R

N

-

D

E

H

N

G

G

A

K

V

V

T

T

R

G

I

I

V

V

E
|
E

E

H

K

K

D

D

A

A

S

T

E

D

S

E

E

Q

V

R

L

Q

I

I

R

Q

E

E

V

I

N
|
N

T
|
T

G

G

I

I

M

L

A

I

V

A

Q

N

G

G

G

A

H

D

L

M

I

K

K

R

W

W

L

L

D

A

R

K

L

L

N

T

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

I

T
|
T

D

D

I

I

E

A

M

L

A

A

V

Y

A

Q

D

E

H

G

V

R

H

E

I

I

A

V

T

A

S

V

Q

H

P

P

K

Q

T

R

I

L

D

S

E

E

V

V

L

E

G

G

V

V

N
|
N

N

N

R

R

S

L

Q

Q

L

L

G

S

H

R

L

L

E

E

R

R

V

V

H

Y

Q

Q

L

S

E

E

Q

Q

A

A

Q

E

Q

K

L

L

M

L

E

L

R

A

G

G

V

V

T

M

L

L

Y

R

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

T

H

H

L

-

G

G

L

R

D

D

I

V

E

E

I

I

D

D

V

T

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

T

I

L

G

G

N

H

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

I

V

K

D

N

S

S

V

V

I

I

E

G

D

D

N

D

A

C

E

E

I

I

L

S

D

P

H

Y

S

T

L

V

I

V

E

E

K

D

A

A

V

N

V

L

G

A

Q

A

G

A

S

C

R

T

I

I

G

G

P

P

F

F

A

A

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

L

R

E

N

G

V

A

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

M

K

K

S

A

S

R

V

L

A

G

D

K

G

G

S

S

K

K

I

A

N

G

H
|
H

L

L

S

T

Y

Y

I

L

G

G

D

D

C

A

T

E

V

I

G

G

S

D

R

N

V

V

N
|
N

V

I

G

G

A

A

G

G

T

T

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G
|
G

S
|
S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

T

I

V

G

G

Q

K

N

G

A

A

T

T

I

I

G
x
A

A
|
A

G

G

S

T

T

T

I

V

T

T

K

R

D

N

S

V

P

G

E

E

N

N

Q

A

L

L

T

A

L

I

S

S

R
|
R

A

V

K

P

Q

Q

V

T

S

Q

I

K

N

E

G

G

W

W

Q

R

R

R

P

P

S

V

K

K

active site: R16 (= R15)
binding coenzyme a: G402 (= G403), S403 (= S404), A420 (≠ G421), A421 (= A422), R438 (= R439)
binding 2-amino-2-deoxy-1-O-phosphono-alpha-D-glucopyranose: H361 (= H362), N375 (= N376)
binding magnesium ion: D103 (= D102), N225 (= N225)
binding uridine-diphosphate-n-acetylglucosamine: L9 (= L8), A10 (= A9), A11 (= A10), G12 (= G11), Q74 (= Q73), Q77 (= Q76), G79 (= G78), T80 (= T79), Y101 (= Y100), D103 (= D102), Y137 (= Y136), G138 (= G137), E152 (= E152), N167 (= N167), T168 (= T168), T197 (= T197), N225 (= N225)

2oi7A E. Coli glmu- complex with udp-glcnac, desulpho-coa and glcnac-1-po4 (see paper)
51% identity, 98% coverage: 3:451/456 of query aligns to 3:449/449 of 2oi7A

query
sites
2oi7A

I

M

T

S

T

V

I

V

I

I

L
|
L

A

A

A
|
A

G
|
G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

L

A

A

G

G

K

K

P

A

L

M

L

V

K

Q

H

H

V

V

Y

I

D

D

M

A

C

A

S

N

E

E

L

L

Q

G

N

A

R

H

I

V

K

H

I

L

I

V

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

L

L

K

E

Q

V

A

L

L

K

K

D

D

L

D

D

N

A

L

D

N

W

W

I

V

E

L

Q
|
Q

K

A

Q

E

Q
|
Q

L

L

G
|
G

T
|
T

G

G

H

H

A

A

V

M

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

A

P

D

A

D

D

E

I

D

V

I

L

L

I

M

L

L

Y
|
Y

G

G

D
|
D

V

V

P

P

L

L

L

I

K

S

L

V

G

E

T

T

V

L

K

Q

H

R

L

L

I

R

A

D

E

A

V

K

S

P

D

Q

K

G

S

G

L

I

A

G

L

L

T

T

V

V

N

K

L

L

E

D

N

D

P

P

R

T

G

G

Y
|
Y

G
|
G

R

R

I

I

V

T

R

R

N

-

D

E

H

N

G

G

A

K

V

V

T

T

R

G

I

I

V

V

E
|
E

E

H

K

K

D

D

A

A

S

T

E

D

S

E

E

Q

V

R

L

Q

I

I

R

Q

E

E

V

I

N
|
N

T

T

G

G

I

I

M

L

A

I

V

A

Q

N

G

G

G

A

H

D

L

M

I

K

K

R

W

W

L

L

D

A

R

K

L

L

N

T

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

L

I

T
|
T

D

D

I

I

E

A

M

L

A

A

V

Y

A

Q

D

E

H

G

V

R

H

E

I

I

A

V

T

A

S

V

Q

H

P

P

K

Q

T

R

I

L

D

S

E

E

V

V

L

E

G

G

V

V

N

N

R

R

S

L

Q

Q

L

L

G

S

H

R

L

L

E

E

R

R

V

V

H

Y

Q

Q

L

S

E

E

Q

Q

A

A

Q

E

Q

K

L

L

M

L

E

L

R

A

G

G

V

V

T

M

L

L

Y

R

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

T

H

H

L

-

G

G

L

R

D

D

I

V

E

E

I

I

D

D

V

T

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

T

I

L

G

G

N

H

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

I

V

K

D

N

S

S

V

V

I

I

E

G

D

D

N

D

A

C

E

E

I

I

L

S

D

P

H

Y

S

T

L

V

I

V

E

E

K

D

A

A

V

N

V

L

G

A

Q

A

G

A

S

C

R

T

I

I

G

G

P

P

F

F

A

A

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

L

R

E

N

G

V

A

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

M

K

K

S

A

S

R

V

L

A

G

D

K

G

G

S

S

K
|
K

I

A

N

G

H
|
H

L

L

S

T

Y

Y

I

L

G

G

D

D

C

A

T

E

V

I

G

G

S

D

R

N

V

V

N
|
N

V

I

G

G

A
|
A

G

G

T

T

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F

F

I

V

G
|
G

S
|
S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

T

I

V

G

G

Q

K

N

G

A

A

T

T

I

I

G
x
A

A
|
A

G

G

S

T

T

T

I

V

T

T

K

R

D

N

S

V

P

G

E

E

N

N

Q

A

L

L

T

A

L

I

S

S

R
|
R

A

V

K

P

Q

Q

V

T

S

Q

I

K

N

E

G

G

W

W

Q

R

R

R

P

P

active site: R15 (= R15)
binding desulfo-coenzyme a: G401 (= G403), S402 (= S404), A419 (≠ G421), A420 (= A422), R437 (= R439)
binding 2-acetamido-2-deoxy-1-O-phosphono-alpha-D-glucopyranose: K357 (= K359), H360 (= H362), N374 (= N376), A377 (= A379)
binding uridine-diphosphate-n-acetylglucosamine: L8 (= L8), A10 (= A10), G11 (= G11), Q73 (= Q73), Q76 (= Q76), G78 (= G78), T79 (= T79), Y100 (= Y100), D102 (= D102), Y136 (= Y136), G137 (= G137), E151 (= E152), N166 (= N167), T196 (= T197)

2oi5A E. Coli glmu- complex with udp-glcnac and acetyl-coa (see paper)
51% identity, 98% coverage: 3:451/456 of query aligns to 3:449/449 of 2oi5A

query
sites
2oi5A

I

M

T

S

T

V

I

V

I

I

L
|
L

A

A

A
|
A

G
|
G

K

K

G

G

T

T

R
|
R

M

M

R

Y

S

S

E

D

L

L

P

P

K

K

V

V

L

L

H

H

K

T

I

L

A

A

G

G

K

K

P

A

L

M

L

V

K

Q

H

H

V

V

Y

I

D

D

M

A

C

A

S

N

E

E

L

L

Q

G

N

A

R

H

I

V

K

H

I

L

I

V

Y

Y

G

G

H

H

G

G

A

G

E

D

Q

L

V

L

L

K

E

Q

V

A

L

L

K

K

D

D

L

D

D

N

A

L

D

N

W

W

I

V

E

L

Q
|
Q

K

A

Q

E

Q
|
Q

L

L

G
|
G

T
|
T

G

G

H

H

A

A

V

M

Q

Q

V

A

K

A

D

P

Q

F

I

F

N

A

P

D

A

D

D

E

I

D

V

I

L

L

I

M

L

L

Y
|
Y

G

G

D
|
D

V

V

P

P

L

L

L

I

K

S

L

V

G

E

T

T

V

L

K

Q

H

R

L

L

I

R

A

D

E

A

V

K

S

P

D

Q

K

G

S

G

L

I

A

G

L

L

T

T

V

V

N

K

L

L

E

D

N

D

P

P

R

T

G

G

Y
|
Y

G
|
G

R

R

I

I

V

T

R

R

N

-

D

E

H

N

G

G

A

K

V

V

T

T

R

G

I

I

V

V

E
|
E

E

H

K

K

D

D

A

A

S

T

E

D

S

E

E

Q

V

R

L

Q

I

I

R

Q

E

E

V

I

N
|
N

T

T

G

G

I

I

M

L

A

I

V

A

Q

N

G

G

G

A

H

D

L

M

I

K

K

R

W

W

L

L

D

A

R

K

L

L

N

T

N

N

H

N

N

N

A

A

Q

Q

G

G

E

E

Y

Y

Y
|
Y

L

I

T
|
T

D

D

I

I

E

A

M

L

A

A

V

Y

A

Q

D

E

H

G

V

R

H

E

I

I

A

V

T

A

S

V

Q

H

P

P

K

Q

T

R

I

L

D

S

E

E

V

V

L

E

G

G

V

V

N

N

R

R

S

L

Q

Q

L

L

G

S

H

R

L

L

E

E

R

R

V

V

H

Y

Q

Q

L

S

E

E

Q

Q

A

A

Q

E

Q

K

L

L

M

L

E

L

R

A

G

G

V

V

T

M

L

L

Y

R

D

D

P

P

V

A

R

R

F

F

D

D

L

L

R

R

G

G

T

T

I

L

E

T

H

H

L

-

G

G

L

R

D

D

I

V

E

E

I

I

D

D

V

T

N

N

V

V

I

I

L

I

E

E

G

G

Q

N

I

V

S

T

I

L

G

G

N

H

N

R

V

V

R

K

I

I

G

G

A

T

N

G

C

C

R

V

I

I

V

K

D

N

S

S

V

V

I

I

E

G

D

D

N

D

A

C

E

E

I

I

L

S

D

P

H

Y

S

T

L

V

I

V

E

E

K

D

A

A

V

N

V

L

G

A

Q

A

G

A

S

C

R

T

I

I

G

G

P

P

F

F

A

A

R

R

L

L

R

R

P

P

E

G

T

A

V

E

I

L

A

L

R

E

N

G

V

A

H

H

I

V

G

G

N

N

F

F

V

V

E

E

I

M

K

K

S

A

S

R

V

L

A

G

D

K

G

G

S

S

K

K

I

A

N

G

H

H

L

L

S

T

Y

Y

I

L

G

G

D

D

C

A

T

E

V

I

G

G

S

D

R

N

V

V

N

N

V

I

G
|
G

A

A

G

G

T

T

I

I

T

T

C

C

N

N

Y

Y

D

D

G

G

V

A

N

N

K

K

F

F

H

K

T

T

V

I

I

I

G

G

D

D

G

D

A

V

F
|
F

I

V

G
|
G

S
|
S

D

D

T

T

Q

Q

L

L

I

V

A

A

P

P

V

V

T

T

I

V

G

G

Q

K

N

G

A

A

T

T

I

I

G
x
A

A
|
A

G

G

S

T

T

T

I

V

T

T

K

R

D

N

S

V

P

G

E

E

N

N

Q

A

L

L

T

A

L

I

S

S

R
|
R

A

V

K

P

Q

Q

V

T

S

Q

I

K

N

E

G

G

W

W

Q

R

R

R

P

P

active site: R15 (= R15)
binding acetyl coenzyme *a: G376 (= G378), F399 (= F401), G401 (= G403), S402 (= S404), A419 (≠ G421), A420 (= A422), R437 (= R439)
binding uridine-diphosphate-n-acetylglucosamine: L8 (= L8), A10 (= A10), G11 (= G11), Q73 (= Q73), Q76 (= Q76), G78 (= G78), T79 (= T79), Y100 (= Y100), D102 (= D102), Y136 (= Y136), G137 (= G137), E151 (= E152), N166 (= N167), Y194 (= Y195), T196 (= T197)

Query Sequence

>WP_020565030.1 NCBI__GCF_000372865.1:WP_020565030.1
MKITTIILAAGKGTRMRSELPKVLHKIAGKPLLKHVYDMCSELQNNRIKIIYGHGAEQVL
EVLKDLDADWIEQKQQLGTGHAVQQVKDQINPADIVLILYGDVPLLKLGTVKHLIAEVSD
KSLALLTVNLENPRGYGRIVRNDHGAVTRIVEEKDASESEVLIREVNTGIMAVQGGHLIK
WLDRLNNHNAQGEYYLTDIIEMAVADHVHIATSQPKTIDEVLGVNNRSQLGHLERVHQLE
QAQQLMERGVTLYDPVRFDLRGTIEHLGLDIEIDVNVILEGQISIGNNVRIGANCRIVDS
VIEDNAEILDHSLIEKAVVGQGSRIGPFARLRPETVIARNVHIGNFVEIKKSSVADGSKI
NHLSYIGDCTVGSRVNVGAGTITCNYDGVNKFHTVIGDGAFIGSDTQLIAPVTIGQNATI
GAGSTITKDSPENQLTLSRAKQVSINGWQRPSKREK

Or try a new SitesBLAST search

SitesBLAST's Database

SitesBLAST's database includes (1) SwissProt entries with experimentally-supported functional features; and (2) protein structures with bound ligands, from the BioLip database.

by Morgan Price, Arkin group
Lawrence Berkeley National Laboratory