SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing 201943 SO2813 oxidoreductase, short chain dehydrogenase/reductase family (NCBI ptt file) to proteins with known functional sites using BLASTp with E ≤ 0.001.

Or try Sites on a Tree, PaperBLAST, Conserved Domains, or compare to all protein structures

Found 20 (the maximum) hits to proteins with known functional sites (download)

5wuwA Serratia marcescens short-chain dehydrogenase/reductase f98l/f202l mutant (see paper)
68% identity, 96% coverage: 12:254/254 of query aligns to 3:245/245 of 5wuwA

query
sites
5wuwA

L

L

Q

Q

G

G

K

K

V

V

A

A

F

F

V

V

Q

Q

G
|
G

G

G

S
|
S

R
|
R

G
|
G

I
|
I

G

G

A

A

I

I

V

V

K

K

R

R

L

L

A

A

S

S

E

E

G

G

A

A

V

V

A

A

F

F

T

T

Y
|
Y

V
x
A

S
x
A

S

S

E

A

A

D

Q

R

S

A

Q

E

L

A

L

V

V

A

D

S

E

A

V

V

I

T

A

T

Q

A

G

G

K

K

A

V

I

L

A

A

I

I

K

K

A
|
A

D
|
D

S
|
S

T

A

E

D

P

A

E

A

A

A

I

L

R

Q

A

A

I

V

R

R

E

Q

T

A

K

V

A

S

H

H

L

F

G

G

G

N

L

L

D

D

I

I

V

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I
x
V

L

L

I

T

W

L

D

G

S

G

I

T

E

E

N

E

L

L

T

A

L

L

E

D

D

D

W

L

E

D

R

R

I

M

V

L

N

A

T
x
V

N

N

V

V

R

R

S

S

V

V

F

F

V

V

A

A

S

S

Q

Q

E

E

A

A

L

R

H

H

M

M

N

N

D

D

G

G

R

R

I

I

N

H

I
|
I

G
|
G

S
|
S

T

T

N

N

A

A

E

E

R

R

I

V

P

P

F

F

V

G

G

G

G

A

A

A

I

V

Y
|
Y

G

A

M

M

S

S

K
|
K

S

S

A

A

L
|
L

V

V

G

G

L

L

A

T

K

K

G

G

L

M

A

A

R

R

D

D

L

L

G

G

P

P

R

R

A

S

I

I

T

T

V

V

N

N

I

V

Q

Q

P
|
P

G
|
G

P
|
P

V
|
V

D

D

T
|
T

D

E

M

M

N
|
N

P

P

D

D

N

A

G

G

D

E

S

L

S

A

E

D

P

Q

I

L

K

K

A

Q

I

L

G

M

V

A

L

I

G

G

R

R

Y

Y

G

G

K

K

A

D

E

E

I

I

A

A

S

G

F

F

V

V

A

A

F

Y

I

L

A

A

G

G

P

P

E

Q

A

A

G

G

Y

Y

I

I

T

T

G

G

A

A

S

S

L

L

M

S

I

I

D

D

G

G

F

F

S

S

A

A

active site: G16 (= G25), S140 (= S149), Y154 (= Y163), L161 (= L170)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G12 (= G21), S14 (= S23), R15 (= R24), G16 (= G25), I17 (= I26), Y36 (= Y45), A37 (≠ V46), A38 (≠ S47), A62 (= A71), D63 (= D72), S64 (= S73), N90 (= N99), A91 (= A100), G92 (= G101), V93 (≠ I102), V113 (≠ T122), I138 (= I147), G139 (= G148), S140 (= S149), Y154 (= Y163), K158 (= K167), P184 (= P193), G185 (= G194), P186 (= P195), V187 (= V196), T189 (= T198), N192 (= N201)

6j7uA Crystal structure of blue fluorescent protein from metagenomic library in complex with NADPH (see paper)
54% identity, 96% coverage: 10:254/254 of query aligns to 1:247/247 of 6j7uA

query
sites
6j7uA

N

Q

N

N

L

L

Q

N

G

G

K

K

V

V

A

A

F

F

V

V

Q

T

G
|
G

G

G

S
|
S

R
|
R

G
|
G

I
|
I

G

G

A

A

I

I

V

V

K

R

R

R

L

L

A

A

S

A

E

D

G

G

A

A

A

D

V

I

A

A

F

F

T

T

Y
|
Y

V
|
V

S
|
S

S

A

E

S

A
x
S

Q

K

-

N

-

V

S

A

Q

T

L

A

L

L

V

V

D

Q

E

E

V

L

I

E

A

A

Q

K

G

G

G

R

K

R

A

A

I

R

A

A

I

I

K

Q

A
|
A

D
|
D

S
|
S

T

A

E

D

P

P

E

A

A

Q

I

V

R

R

R

Q

A

A

I

V

R

E

E

Q

T

A

K

I

A

V

H

Q

L

L

G

G

G

P

L

V

D

D

I

V

V

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I

I

L

F

I

L

W

A

D

G

S

P

I

L

E

G

N

E

L

V

T

T

L

L

E

D

D

D

W

Y

E

E

R

R

I

T

V

M

N

N

T
x
I

N

N

V

V

R

R

S

A

V

P

F

F

V

V

A

A

S

I

Q

Q

E

A

A

A

A

Q

L

A

H

S

M

M

N

P

D

D

G

G

R

R

I

I

N

N

I
|
I

G
|
G

S
|
S

T

C

N

L

A

A

E

E

R

R

I

A

P

G

F

R

V

A

G

G

G

V

A

T

I

L

Y
|
Y

G

A

M

A

S

S

K
|
K

S

S

A

A

L

L

V

L

G

G

L

M

A

T

K

R

G

G

L

L

A

A

R

R

D

D

L

L

G

G

P

A

R

R

A

G

I

I

T

T

V

A

N

N

N

V

I

V

Q

H

P
|
P

G
|
G

P
|
P

V
x
I

D

D

T
|
T

D
|
D

M
|
M

N
|
N

P

P

D

A

N

D

G

G

D

E

S

R

S

S

E

G

P

E

I

L

K

V

A

A

I

V

G

L

V

S

L

L

G

P

R

H

Y

Y

G

G

K

E

A

V

E

R

E

D

I

I

A

A

S

G

F

M

V

V

A

A

F

F

I

L

A

A

G

G

P

P

E

D

A

G

G

R

Y

Y

I

V

T

T

G

G

A

A

S

S

L

L

M

A

I

V

D

D

G

G

F

F

S

A

A

A

active site: G16 (= G25), S142 (= S149), Y156 (= Y163)
binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G12 (= G21), S14 (= S23), R15 (= R24), G16 (= G25), I17 (= I26), Y36 (= Y45), V37 (= V46), S38 (= S47), S41 (≠ A50), A64 (= A71), D65 (= D72), S66 (= S73), N92 (= N99), A93 (= A100), G94 (= G101), I115 (≠ T122), I140 (= I147), G141 (= G148), S142 (= S149), Y156 (= Y163), K160 (= K167), P186 (= P193), G187 (= G194), P188 (= P195), I189 (≠ V196), T191 (= T198), D192 (= D199), M193 (= M200), N194 (= N201)

5u2wA Crystal structure of a short chain dehydrogenase from burkho cenocepacia j2315 in complex with NADP
52% identity, 96% coverage: 10:254/254 of query aligns to 2:246/246 of 5u2wA

query
sites
5u2wA

N

N

N

R

L

L

Q

Q

G

G

K

K

V

R

A

A

F

L

V

V

Q

T

G
|
G

G

G

S
|
S

R
|
R

G
|
G

I
|
I

G

G

A

A

I

I

V

A

K

K

R

R

L

L

A

A

S

A

E

D

G

G

A

A

A

D

V

V

A

A

F

I

T

T

Y
|
Y

V
x
E

S
x
K

S
|
S

E

A

A

E

Q

R

S

A

Q

Q

L

A

L

V

V

V

D

A

E

G

V

I

I

E

A

A

Q

L

G

G

G

R

K

R

A

A

I

I

A

A

I

I

K

Q

A
|
A

D
|
D

S
|
S

T

A

E

D

P

P

E

V

A

A

I

V

R

R

R

N

A

A

I

V

R

D

E

R

T

V

K

A

A

E

H

A

L

F

G

G

L

L

D

D

I

I

V

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I
|
I

L

F

I

R

W

A

D

G

S

S

I

L

E

D

N

D

L

L

T

T

L

L

E

D

D

D

W

I

E

D

R

A

I

T

V

L

N

N

T
x
V

N

N

V

V

R

R

S

A

V

V

F

I

V

V

A

A

S

S

Q

Q

E

A

A

A

L

R

H

H

M

L

N

G

D

E

G

G

R

R

I

I

I

V

N

S

I
x
T

G
|
G

S
|
S

T

C

N

L

A

A

E

T

R

R

I

V

P

P

F

D

V

A

G

G

G
x
M

A

S

I

L

Y
|
Y

G

A

M

A

S

S

K
|
K

S

A

A

A

L

L

V

I

G

G

L

W

A

T

K

Q

G

G

L

L

A

A

R

R

D

D

L

L

G

G

P

P

R

R

A

G

I

I

T

T

V

V

N

N

N

I

I

V

Q

H

P
|
P

G
|
G

P
x
S

V
x
T

D

D

T
|
T

D
|
D

M
|
M

N
|
N

P

P

D

A

N

D

G

G

D

A

S

H

S

A

E

D

P

A

I

Q

K

R

A

S

I

R

G

M

V

A

L

I

G

Q

R

Q

Y

Y

G

G

K

K

A

A

E

D

I

V

A

A

S

A

F

L

V

V

A

A

F

F

I

V

A

V

G

G

P

P

E

E

A

G

G

R

Y

S

I

I

T

N

G

G

A

T

S

G

L

L

M

T

I

I

D

D

G

G

F

A

S

N

A

A

active site: G17 (= G25), S141 (= S149), M152 (≠ G160), Y155 (= Y163), K159 (= K167)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G13 (= G21), S15 (= S23), R16 (= R24), G17 (= G25), I18 (= I26), Y37 (= Y45), E38 (≠ V46), K39 (≠ S47), S40 (= S48), A63 (= A71), D64 (= D72), S65 (= S73), N91 (= N99), A92 (= A100), G93 (= G101), I94 (= I102), V114 (≠ T122), T139 (≠ I147), G140 (= G148), S141 (= S149), Y155 (= Y163), K159 (= K167), P185 (= P193), G186 (= G194), S187 (≠ P195), T188 (≠ V196), T190 (= T198), D191 (= D199), M192 (= M200), N193 (= N201)

5z2lK Crystal structure of bdca in complex with NADPH (see paper)
45% identity, 96% coverage: 12:254/254 of query aligns to 3:236/244 of 5z2lK

query
sites
5z2lK

L

F

Q

T

G

G

K

K

V

T

A

V

F

L

V

I

Q

L

G
|
G

S
|
S

R
|
R

G
|
G

I
|
I

G

G

A

A

I

I

V

V

K

R

R

R

L

F

A

V

S

T

E

D

G

G

A

A

A

N

V

V

A

R

F

F

T

T

Y
|
Y

V
x
A

S
x
G

S
|
S

E

K

A

D

Q

A

S

A

Q

K

L

R

L

L

V

A

D

Q

E

E

V

T

I

-

A

-

Q

-

G

-

K

G

A

A

I

T

A

A

I

V

K

F

A
x
T

D
|
D

S
|
S

T

A

E

D

P

R

E

D

A

A

I

V

R

I

R

D

A

V

I

V

R

R

E

K

T

S

K

-

A

-

H

-

L

-

G

G

G

A

L

L

D

D

I

I

V

L

V

V

N

V

N
|
N

A
|
A

G
|
G

I
|
I

L

G

I

V

W

F

D

G

S

E

I

A

E

L

N

E

L

L

T

N

L

A

E

D

D

D

W

I

E

D

R

R

I

L

V

F

N

K

T
x
I

N

N

V

I

R

H

S

A

V

P

F

Y

V

H

A

A

S

S

Q

V

E

E

A

A

L

R

H

Q

M

M

N

P

D

E

G

G

R

R

I

I

I

L

N

I

I
|
I

G
|
G

S
|
S

T

V

N

N

A

G

E

D

R

R

I

M

P

P

F

V

V

A

G

G

G

M

A

A

I

A

Y
|
Y

G

A

M

A

S

S

K
|
K

S

S

A

A

L

L

V

Q

G

G

L

M

A

A

K

R

G

G

L

L

A

A

R

R

D

D

L

F

G

G

P

P

R

R

A

G

I

I

T

T

V

I

N

N

N

V

I

V

Q

Q

P
|
P

G
|
G

P
|
P

V
x
I

D

D

T
|
T

D
|
D

M
x
A

N
|
N

P

P

D

A

N

N

G

G

D

P

S

M

S

R

E

D

P

M

I

L

K

H

A

S

I

L

G

M

V

A

L

I

G

K

R

R

Y

H

G

G

K

Q

A

P

E

E

I

V

A

A

S

G

F

M

V

V

A

A

F

W

I

L

A

A

G

G

P

P

E

E

A

A

G

S

Y

F

I

V

T

T

G

G

A

A

S

M

L

H

M

T

I

I

D

D

G

G

G

A

F

F

S

G

A

A

binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G12 (= G21), G13 (= G22), S14 (= S23), R15 (= R24), G16 (= G25), I17 (= I26), Y36 (= Y45), A37 (≠ V46), G38 (≠ S47), S39 (= S48), T57 (≠ A71), D58 (= D72), S59 (= S73), N81 (= N99), A82 (= A100), G83 (= G101), I84 (= I102), I104 (≠ T122), I129 (= I147), G130 (= G148), S131 (= S149), Y145 (= Y163), K149 (= K167), P175 (= P193), G176 (= G194), P177 (= P195), I178 (≠ V196), T180 (= T198), D181 (= D199), A182 (≠ M200), N183 (= N201)

P39333 Cyclic-di-GMP-binding biofilm dispersal mediator protein from Escherichia coli (strain K12) (see paper)
45% identity, 96% coverage: 12:254/254 of query aligns to 4:237/237 of P39333

query
sites
P39333

L

F

Q

T

G

G

K

K

V

T

A

V

F

L

V

I

Q

L

G

G

S

S

R

R

G

G

I

I

G

G

A

A

I

I

V

V

K

R

R

R

L

F

A

V

S

T

E

D

G

G

A

A

A

N

V

V

A

R

F

F

T

T

Y

Y

V

A

S

G

S

S

E

K

A

D

Q

A

S

A

Q

K

L

R

L

L

V

A

D

Q

E
|
E

V

T

I

-

A

-

Q

-

G

-

K

G

A

A

I

T

A

A

I

V

K

F

A

T

D

D

S

S

T

A

E

D

P

R

E

D

A

A

I

V

R

I

R

D

A

V

I

V

R

R

E

K

T

S

K

-

A

-

H

-

L

-

G

G

G

A

L

L

D

D

I

I

V

L

V

V

N

V

N

N

A

A

G

G

I

I

L

G

I

V

W

F

D

G

S

E

I

A

E

L

N

E

L

L

T

N

L

A

E

D

D

D

W

I

E

D

R

R

I

L

V

F

N

K

T

I

N

N

V

I

R

H

S

A

V

P

F

Y

V

H

A

A

S

S

Q

V

E

E

A

A

L

R

H

Q

M

M

N

P

D

E

G

G

R

R

I

I

I

L

N

I

I

I

G

G

S

S

T

V

N

N

A

G

E

D

R

R

I

M

P

P

F

V

V

A

G

G

G

M

A

A

I

A

Y

Y

G

A

M

A

S

S

K

K

S

S

A

A

L

L

V

Q

G

G

L

M

A

A

K

R

G

G

L

L

A

A

R

R

D

D

L

F

G

G

P

P

R

R

A

G

I

I

T

T

V

I

N

N

N

V

I

V

Q

Q

P

P

G

G

P

P

V

I

D

D

T

T

D

D

M

A

N

N

P

P

D

A

N

N

G

G

D

P

S

M

S

R

E

D

P

M

I

L

K

H

A

S

I

L

G

M

V

A

L

I

G

K

R

R

Y

H

G

G

K

Q

A

P

E

E

I

V

A

A

S

G

F

M

V

V

A

A

F

W

I

L

A

A

G

G

P

P

E

E

A

A

G

S

Y

F

I

V

T

T

G

G

A

A

S

M

L

H

M

T

I

I

D

D

G

G

G

A

F

F

S

G

A

A

E50 (= E58) mutation E->Q,V: Shows higher affinity for cyclic-di-GMP, increases swimming motility and biofilm dispersal. Biofilm formation is almost completely removed.

4i08A Crystal structure of beta-ketoacyl-acyl carrier protein reductase (fabg) from vibrio cholerae in complex with NADPH (see paper)
40% identity, 95% coverage: 11:252/254 of query aligns to 5:240/243 of 4i08A

query
sites
4i08A

N

N

L

L

Q

E

G

G

K

K

V

V

A

A

F

L

V

V

Q

T

G
|
G

G

A

S
|
S

R
|
R

G
|
G

I
|
I

G

G

A

K

A

A

I

I

V

A

K

E

R

L

L

L

A

A

S

E

E

R

G

G

A

A

A

K

V

V

A

I

F

G

T

T

Y

-

V
x
A

S
x
T

S

S

E

E

A

S

Q

G

S

A

Q

Q

L

A

L

I

V

S

D

D

E

-

V

Y

I

L

A

G

Q

D

G

N

G

G

K

K

A

G

I

M

A

A

I
x
L

K

-

A

-

D
x
N

S
x
V

T

T

E

N

P

P

E

E

A

S

I

I

R

E

R

A

A

V

I

L

R

K

E

A

T

I

K

T

A

D

H

E

L

F

G

G

L

V

D

D

I

I

V

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I
|
I

L

T

I

R

W

D

D

N

S

L

I

L

E

M

N

R

L

M

T

K

L

E

E

E

D

E

W

W

E

S

R

D

I

I

V

M

N

E

T
|
T

N
|
N

V

L

R

T

S

S

V

I

F

F

V

R

A

L

S

S

Q

K

E

A

A

V

A

L

L

R

H

G

M

M

-

M

-

K

N

K

D

R

G

Q

G

G

R

R

I

I

N

N

I
x
V

G
|
G

S
|
S

T

V

N

-

A

V

E

G

R

T

I

M

P

G

F

N

V

A

G

G

G
x
Q

A

A

I

N

Y
|
Y

G

A

M

A

S

A

K
|
K

S

A

A

G

L

V

V

I

G

G

L

F

A

T

K

K

G

S

L

M

A

A

R

R

D

E

L

V

G

A

P

S

R

R

A

G

I

V

T

T

V

V

N

N

N

T

I

V

Q

A

P
|
P

G
|
G

P
x
F

V
x
I

D

E

T
|
T

D

D

M

M

N

N

P

D

D

E

N

Q

G

R

D

T

S

A

S

T

-

L

E

A

P

Q

I

V

K

P

A

A

I

-

G

-

V

-

L

-

G

G

R

R

Y

L

G

G

K

D

A

P

E

R

E

E

I

I

A

A

S

S

F

A

V

V

A

A

F

F

I

L

A

A

G

S

P

P

E

E

A

A

G

A

Y

Y

I

I

T

T

G

G

A

E

S

T

L

L

M

H

I

V

D

N

G

G

F

M

active site: G19 (= G25), N113 (= N123), S141 (= S149), Q151 (≠ G160), Y154 (= Y163), K158 (= K167)
binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G15 (= G21), S17 (= S23), R18 (= R24), G19 (= G25), I20 (= I26), A39 (≠ V46), T40 (≠ S47), L61 (≠ I69), N62 (≠ D72), V63 (≠ S73), N89 (= N99), A90 (= A100), G91 (= G101), I92 (= I102), T112 (= T122), V139 (≠ I147), G140 (= G148), S141 (= S149), Y154 (= Y163), K158 (= K167), P184 (= P193), G185 (= G194), F186 (≠ P195), I187 (≠ V196), T189 (= T198)

3op4A Crystal structure of putative 3-ketoacyl-(acyl-carrier-protein) reductase from vibrio cholerae o1 biovar eltor str. N16961 in complex with NADP+ (see paper)
40% identity, 95% coverage: 11:252/254 of query aligns to 5:244/247 of 3op4A

query
sites
3op4A

N

N

L

L

Q

E

G

G

K

K

V

V

A

A

F

L

V

V

Q

T

G
|
G

G

A

S
|
S

R
|
R

G
|
G

I
|
I

G

G

A

K

A

A

I

I

V

A

K

E

R

L

L

L

A

A

S

E

E

R

G

G

A

A

A

K

V

V

A

I

F

G

T

T

Y

-

V
x
A

S
x
T

S

S

E

E

A

S

Q

G

S

A

Q

Q

L

A

L

I

V

S

D

D

E

-

V

Y

I

L

A

G

Q

D

G

N

G

G

K

K

A

G

I

M

A

A

I
x
L

K

-

A

-

D
x
N

S
x
V

T

T

E

N

P

P

E

E

A

S

I

I

R

E

R

A

A

V

I

L

R

K

E

A

T

I

K

T

A

D

H

E

L

F

G

G

L

V

D

D

I

I

V

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I
|
I

L

T

I

R

W

D

D

N

S

L

I

L

E

M

N

R

L

M

T

K

L

E

E

E

D

E

W

W

E

S

R

D

I

I

V

M

N

E

T
|
T

N

N

V

L

R

T

S

S

V

I

F

F

V

R

A

L

S

S

Q

K

E

A

A

V

A

L

L

R

H

G

M

M

-

M

-

K

N

K

D

R

G

Q

G

G

R

R

I

I

N

N

I
x
V

G
|
G

S
|
S

T

V

N

-

A

V

E

G

R

T

I

M

P

G

F

N

V

A

G

G

G

Q

A

A

I

N

Y
|
Y

G

A

M

A

S

A

K
|
K

S

A

A

G

L

V

V

I

G

G

L

F

A

T

K

K

G

S

L

M

A

A

R

R

D

E

L

V

G

A

P

S

R

R

A

G

I

V

T

T

V

V

N

N

N

T

I

V

Q

A

P
|
P

G
|
G

P
x
F

V
x
I

D

E

T
|
T

D
|
D

M
|
M

N

T

P

K

D

A

N

L

G

N

D

D

S

E

S

Q

E

R

P

T

I

A

K

T

A

L

I

A

G

Q

V

V

-

P

L

A

G

G

R

R

Y

L

G

G

K

D

A

P

E

R

E

E

I

I

A

A

S

S

F

A

V

V

A

A

F

F

I

L

A

A

G

S

P

P

E

E

A

A

G

A

Y

Y

I

I

T

T

G

G

A

E

S

T

L

L

M

H

I

V

D

N

G

G

F

M

binding nadp nicotinamide-adenine-dinucleotide phosphate: G15 (= G21), S17 (= S23), R18 (= R24), G19 (= G25), I20 (= I26), A39 (≠ V46), T40 (≠ S47), L61 (≠ I69), N62 (≠ D72), V63 (≠ S73), N89 (= N99), A90 (= A100), G91 (= G101), I92 (= I102), T112 (= T122), V139 (≠ I147), G140 (= G148), S141 (= S149), Y154 (= Y163), K158 (= K167), P184 (= P193), G185 (= G194), F186 (≠ P195), I187 (≠ V196), T189 (= T198), D190 (= D199), M191 (= M200)

7v0hG Crystal structure of putative glucose 1-dehydrogenase from burkholderia cenocepacia in complex with NADP and a potential reaction product
38% identity, 96% coverage: 10:253/254 of query aligns to 7:253/253 of 7v0hG

query
sites
7v0hG

N

S

N

K

L

L

Q

A

G

G

K

K

V

V

A

A

F

I

V

V

Q

T

G
|
G

G

A

S
|
S

R
x
K

G
|
G

I
|
I

G

G

A

A

I

I

V

A

K

K

R

A

L

L

A

A

S

D

E

E

G

G

A

A

V

V

A

V

F

V

T
x
N

Y
|
Y

V
x
A

S
|
S

E

K

A

A

Q

G

S

A

Q

D

L

A

L

V

V

V

D

S

E

A

V

I

I

T

A

E

Q

A

G

G

K

R

A

A

I

V

A

A

I

V

K

G

A
x
G

D
|
D

S
x
V

T

S

E

K

P

A

E

A

A

D

I

A

R

Q

R

R

A

I

I

V

R

D

E

T

T

A

K

I

A

E

H

T

L

Y

G

G

G

R

L

L

D

D

I

V

V

L

V

V

N

N

N
|
N

A
x
S

G
|
G

I
x
V

L
x
Y

I

E

W
x
F

D

A

S

P

I

I

E

E

N

A

L

I

T

T

L

E

E

E

D

H

W

Y

E

R

R

R

I

Q

V

F

N

D

T
|
T

N

N

V

V

R

F

S

G

V

V

F

L

V

L

A

T

S

T

Q

Q

E

A

A

A

A

V

L

K

H

H

M

L

N

G

D

E

G

G

G

A

R

S

I

I

N

N

I
|
I

G
x
S

S
|
S

T
x
V

N
x
V

A

T

E

S

R

I

I

T

P

P

F

-

V

P

G

A

G

S

A

A

I

V

Y
|
Y

G

S

M

G

S

T

K
|
K

S

G

A

A

L

V

V

D

G

A

L

I

A

T

K

G

G

V

L

L

A

A

R

L

D

E

L

L

G

G

P

P

R

R

A

K

I

I

T

R

V

V

N

N

N

A

I

I

Q

N

P
|
P

G
|
G

P
x
M

V
x
I

D

V

T
|
T

D
x
E

M
x
G

N
x
T

P

H

D

S

N

A

G

G

-
x
I

-

I

-

G

-

S

D

D

S

L

S

E

E

A

P

Q

I
x
V

K

L

A

G

I

Q

G

T

V

P

L

L

G

G

R

R

Y

L

G

G

K

E

A

P

E

N

E

D

I

I

A

A

S

S

F

V

V

A

A

V

F

F

I

L

A

A

G

S

P

D

E

D

A

A

G

R

Y

W

I

M

T

T

G

G

A

E

S

H

L

L

M

V

I

V

D

S

G

G

F

L

S

N

binding nadp nicotinamide-adenine-dinucleotide phosphate: G18 (= G21), S20 (= S23), K21 (≠ R24), G22 (= G25), I23 (= I26), N41 (≠ T44), Y42 (= Y45), A43 (≠ V46), S44 (= S47), S45 (= S48), G68 (≠ A71), D69 (= D72), V70 (≠ S73), N96 (= N99), S97 (≠ A100), G98 (= G101), V99 (≠ I102), Y100 (≠ L103), T119 (= T122), I144 (= I147), S145 (≠ G148), S146 (= S149), Y159 (= Y163), K163 (= K167), P189 (= P193), G190 (= G194), M191 (≠ P195), I192 (≠ V196), T194 (= T198), E195 (≠ D199), G196 (≠ M200), T197 (≠ N201)
binding (2R)-2-(hydroxymethyl)pentanedioic acid: Y100 (≠ L103), F102 (≠ W105), S146 (= S149), V147 (≠ T150), V148 (≠ N151), Y159 (= Y163), G190 (= G194), M191 (≠ P195), I202 (vs. gap), V211 (≠ I211)

3tzcA Crystal structure of 3-ketoacyl-(acyl-carrier-protein) reductase (fabg)(y155f) from vibrio cholerae (see paper)
39% identity, 95% coverage: 11:252/254 of query aligns to 5:223/224 of 3tzcA

query
sites
3tzcA

N

N

L

L

Q

E

G

G

K

K

V

V

A

A

F

L

V

V

Q

T

G
|
G

G

A

S
|
S

R
|
R

G

G

I

I

G

G

A

K

A

A

I

I

V

A

K

E

R

L

L

L

A

A

S

E

E

R

G

G

A

A

A

K

V

V

A

I

F

G

T

T

Y

-

V
x
A

S
x
T

S

S

E

E

A

S

Q

G

S

A

Q

Q

L

A

L

I

V

S

D

D

E

-

V

Y

I

L

A

G

Q

D

G

N

G

G

K

K

A

G

I

M

A

A

I
x
L

K

-

A

-

D
x
N

S
x
V

T

T

E

N

P

P

E

E

A

S

I

I

R

E

R

A

A

V

I

L

R

K

E

A

T

I

K

T

A

D

H

E

L

F

G

G

L

V

D

D

I

I

V

L

V

V

N

N

A
|
A

G
|
G

I
|
I

L
x
T

I

R

W

M

D

R

S

M

I

K

E

E

N

-

L

-

T

-

L

-

E

E

D

E

W

W

E

S

R

D

I

I

V

M

N

E

T
|
T

N

N

V

L

R

T

S

S

V

I

F

F

V

R

A

L

S

S

Q

K

E

A

A

V

A

L

L

R

H

G

M

M

-

M

-

K

N

K

D

R

G

Q

G

G

R

R

I

I

N

N

I

V

G

G

S

S

T

V

N

V

A

A

E

-

R

-

I

-

P

-

F

-

V

-

G

-

A

-

I

-

Y

-

G

-

M

-

S

A

K

K

S

A

A

G

L

V

V

I

G

G

L

F

A

T

K

K

G

S

L

M

A

A

R

R

D

E

L

V

G

A

P

S

R

R

A

G

I

V

T

T

V

V

N

N

N

T

I

V

Q

A

P

P

G

G

P

F

V

I

D

E

T

T

D

D

M

M

N

D

P

E

D

Q

N

R

G

T

D

A

S

T

S

L

E

A

P

Q

I

V

K

P

A

A

I

-

G

-

V

-

L

-

G

G

R

R

Y

L

G

G

K

D

A

P

E

R

E

E

I

I

A

A

S

S

F

A

V

V

A

A

F

F

I

L

A

A

G

S

P

P

E

E

A

A

G

A

Y

Y

I

I

T

T

G

G

A

E

S

T

L

L

M

H

I

V

D

N

G

G

F

M

binding nadp nicotinamide-adenine-dinucleotide phosphate: G15 (= G21), S17 (= S23), R18 (= R24), A39 (≠ V46), T40 (≠ S47), L61 (≠ I69), N62 (≠ D72), V63 (≠ S73), A90 (= A100), G91 (= G101), I92 (= I102), T93 (≠ L103), T108 (= T122)

1g6kA Crystal structure of glucose dehydrogenase mutant e96a complexed with NAD+
34% identity, 96% coverage: 11:253/254 of query aligns to 4:251/261 of 1g6kA

query
sites
1g6kA

N

D

L

L

Q

E

G

G

K

K

V

V

A

V

F

V

V

I

Q

T

G
|
G

G

S

S

S

R
x
T

G
|
G

I
x
L

G

G

A

K

A

S

I

M

V

A

K

I

R

R

L

F

A

A

S

T

E

E

G

K

A

A

A

K

V

V

A

V

F

V

T
x
N

Y

Y

V
x
R

S

S

S

K

E

E

A

D

Q

E

S

A

Q

N

L

S

L

V

V

L

D

E

E

E

V

I

I

K

A

K

Q

V

G

G

K

E

A

A

I

I

A

A

I

V

K

K

A
x
G

D
|
D

S
x
V

T

T

E

V

P

E

E

S

A

D

I

V

R

I

R

N

A

L

I

V

R

Q

E

S

T

A

K

I

A

K

H

E

L

F

G

G

G

K

L

L

D

D

I

V

V

M

V

I

N

N

N
|
N

A
|
A

G
|
G

I

L

L

A

I

N

W

P

D

V

S

S

I

S

E

H

N

E

L

M

T

S

L

L

E

S

D

D

W

W

E

N

R

K

I

V

V

I

N

D

T
|
T

N

N

V

L

R

T

S

G

V

A

F

F

V

L

A

G

S

S

Q

R

E

E

A

A

A

I

L

K

H

Y

M

F

-

V

-

E

N

N

D

D

-

I

G

K

G

G

R

T

I

V

I

I

N

N

I
x
M

G
x
S

S
|
S

T

V

N

H

A

-

E

E

R

K

I

I

P

P

F

W

V

P

G

L

G

F

A

V

I

H

Y
|
Y

G

A

M

A

S

S

K
|
K

S

G

A

G

L

M

V

K

G

L

L

M

A

T

K

E

G

T

L

L

A

A

R

L

D

E

L

Y

G

A

P

P

R

K

A

G

I

I

T

R

V

V

N

N

I

I

Q

G

P
|
P

G
|
G

P
x
A

V
x
I

D

N

T
|
T

D

P

M
x
I

N
|
N

P

A

D

E

N

K

G

F

D

A

S

D

S

P

E

E

P

Q

-

R

-

A

-

D

I

V

K

E

A

S

I

M

G

I

V

P

L

M

G

G

R

Y

Y

I

G

G

K

E

A

P

E

E

I

I

A

A

S

A

F

V

V

A

A

A

F

W

I

L

A

A

G

S

P

S

E

E

A

A

G

S

Y

Y

I

V

T

T

G

G

A

I

S

T

L

L

M

F

I

A

D

D

G

G

F

M

S

T

active site: G18 (= G25), S145 (= S149), Y158 (= Y163), K162 (= K167)
binding nicotinamide-adenine-dinucleotide: G14 (= G21), T17 (≠ R24), G18 (= G25), L19 (≠ I26), N37 (≠ T44), R39 (≠ V46), G64 (≠ A71), D65 (= D72), V66 (≠ S73), N92 (= N99), A93 (= A100), G94 (= G101), T115 (= T122), M143 (≠ I147), S144 (≠ G148), S145 (= S149), Y158 (= Y163), K162 (= K167), P188 (= P193), G189 (= G194), A190 (≠ P195), I191 (≠ V196), T193 (= T198), I195 (≠ M200), N196 (= N201)

P73574 3-oxoacyl-[acyl-carrier-protein] reductase; 3-ketoacyl-acyl carrier protein reductase; EC 1.1.1.100 from Synechocystis sp. (strain PCC 6803 / Kazusa) (see paper)
37% identity, 95% coverage: 12:252/254 of query aligns to 4:244/247 of P73574

query
sites
P73574

L

L

Q

T

G

A

K

Q

V

V

A

A

F

L

V

V

Q

T

G

G

G
x
A

S

S

R

R

G

G

I

I

G

G

A

K

A

A

I

T

V

A

K

L

R

A

L

L

A

A

S

A

E

T

G

G

A

M

A

K

V

V

A

V

F

V

T

N

Y

Y

V

A

S

Q

S

S

E

S

A

T

Q

A

S

A

Q

D

L

A

L

V

V

V

D

A

E

E

V

I

I

I

A

A

Q

N

G

G

K

E

A

A

I

I

A

A

I

V

K

Q

A

A

D

N

S

V

T

A

E

N

P

A

E

D

A

E

I

V

R

D

R

Q

A

L

I

I

R

K

E

T

T

T

K

L

A

D

H

K

L

F

G

S

G

R

L

I

D

D

I

V

V

L

V

V

N

N

A

A

G

G

I

I

L

T

I

R

W

D

D

T

S

L

I

L

E

L

N

R

L

M

T

K

L

L

E

E

D

D

W

W

E

Q

R

A

I

V

V

I

N

D

T

L

N

N

V

L

R

T

S

G

V

V

F

F

V

L

A

C

S

T

Q

K

E

A

A

V

A

S

L

K

H

L

M

M

-

L

-

K

N

Q

D

K

G

S

G

G

R

R

I

I

N

N

I

I

G

T

S

S

T

V

N

-

A

A

E

G

R

M

I

M

P

G

F

N

V
x
P

G

G

G

Q

A

A

I

N

Y

Y

G

S

M

A

S

A

K
|
K

S

A

A

G

L

V

V

I

G

G

L

F

A

T

K

K

G

T

L

V

A

A

R

K

D

E

L

L

G

A

P

S

R

R

A

G

I

V

T

T

V

V

N

N

N

A

I

V

Q

A

P

P

G

G

P
x
F

V

I

D

A

T

T

D

D

M

M

N

T

P

E

D

N

N

-

G

-

D

L

S
x
N

S

A

E

E

P

P

I

I

K

L

A

Q

I

F

G

I

V

P

L

L

G

A

R

R

Y

Y

G

G

K

Q

A

P

E

E

I

V

A

A

S

G

F

T

V

I

A

R

F

F

I

L

A

A

-

T

G

D

P

P

E

A

A

A

G

A

Y

Y

I

I

T

T

G

G

A

Q

S

T

L

F

M

N

I

V

D

D

G

G

F

M

A14 (≠ G22) mutation to G: 4.2-fold increase in activity on acetoacetyl-CoA.
P151 (≠ V158) mutation to F: 2.7-fold increase in activity on acetoacetyl-CoA.; mutation to V: 5.7-fold increase in activity on acetoacetyl-CoA.
K160 (= K167) mutation to A: Almost no activity on acetoacetyl-CoA.
F188 (≠ P195) mutation to Y: 3.3-fold increase in activity on acetoacetyl-CoA.
N198 (≠ S207) mutation to R: 3.5-fold increase in activity on acetoacetyl-CoA.

7nm8AAA Antimycin pathway standalone ketoreductase, AntM (see paper)
38% identity, 96% coverage: 9:251/254 of query aligns to 1:247/251 of 7nm8AAA

query
sites
7nm8AAA

S

T

N

Q

N

R

L

H

Q

Q

G

G

K

R

V

T

A

A

F

L

V

V

Q

T

G
|
G

G

G

S
|
S

R
|
R

G
|
G

I
|
I

G

G

A

R

A

A

I

I

V

S

K

R

R

R

L

L

A

A

S

A

E

E

G

G

A

A

A

L

V

V

A

A

F

V

T
x
H

Y
|
Y

V
x
G

S
x
H

S
x
D

E

H

A

A

Q

A

S

A

Q

E

L

R

L

T

V

V

D

K

E

E

V

I

I

E

A

T

Q

D

G

G

K

R

A

A

I

F

A

P

I

V

K

H

A
|
A

D
x
E

-
x
L

-

G

-

V

S

E

T

G

E

D

P

A

E

A

A

T

I

L

R

W

R

A

A

A

I

F

R

D

E

E

T

A

K

L

A

S

H

G

L

T

G

G

-

S

-

G

-

P

G

G

L

L

D

D

I

I

V

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I
|
I

L

T

I

L

W

P

D

R

S

P

I

I

E

A

N

A

L

V

T

T

L

E

E

A

D

E

W

Y

E

D

R
|
R

I

V

V

F

N

A

T
x
V

N

N

V

T

R

R

S

A

V

P

F

F

V

F

A

I

S

V

Q

Q

E

R

A

S

A

L

L

E

H

R

M

L

N

R

D

D

G

G

R

R

I

I

N

S

I
|
I

G

-

S
|
S

T
x
S

N

A

A

A

E

T

R

Q

I

T

P

A

F

Y

V

P

G

A

G

I

A

V

I

A

Y
|
Y

G

S

M

M

S

S

K
|
K

S

G

A

A

L

L

V

D

G

V

L

L

A

T

K

P

G

A

L

L

A

A

R

K

D

Q

L

L

G

G

P

P

R

R

A

G

I

I

T

T

V

V

N

N

N

T

I

V

Q

A

P
|
P

G
|
G

P
x
F

V
x
T

D

E

T
|
T

D

E

M

I

N

L

P

-

D

S

N

N

G

P

D

E

S

I

S

R

E

K

P

A

I

L

K

S

A

S

I

A

G

S

V

V

L

F

G

G

R

R

Y

L

G

G

K

A

A

P

E

A

E

D

I

I

A

A

S

D

F

V

V

V

A

S

F

F

I

V

A

A

G

S

P

D

E

E

A

A

G

R

Y

W

I

V

T

T

G

G

A

Q

S

W

L

I

M

D

I

A

D

T

G

G

binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G13 (= G21), S15 (= S23), R16 (= R24), G17 (= G25), I18 (= I26), H36 (≠ T44), Y37 (= Y45), G38 (≠ V46), H39 (≠ S47), D40 (≠ S48), A63 (= A71), E64 (≠ D72), L65 (vs. gap), N97 (= N99), A98 (= A100), G99 (= G101), I100 (= I102), R116 (= R118), V120 (≠ T122), I145 (= I147), S146 (= S149), S147 (≠ T150), Y160 (= Y163), K164 (= K167), P190 (= P193), G191 (= G194), F192 (≠ P195), T193 (≠ V196), T195 (= T198)

P40288 Glucose 1-dehydrogenase; EC 1.1.1.47 from Priestia megaterium (Bacillus megaterium) (see 2 papers)
34% identity, 96% coverage: 11:253/254 of query aligns to 4:251/261 of P40288

query
sites
P40288

N

D

L

L

Q

E

G

G

K

K

V

V

A

V

F
x
V

V
x
I

Q
x
T

G
|
G

G
x
S

S
|
S

R
x
T

G
|
G

I
x
L

G
|
G

A
x
K

A
x
S

I
x
M

V
x
A

K
x
I

R
|
R

L
x
F

A
|
A

S
x
T

E
|
E

G
x
K

A
|
A

A
x
K

V
|
V

A
x
V

F

V

T

N

Y

Y

V

R

S

S

S

K

E

E

A

D

Q

E

S

A

Q

N

L

S

L

V

V

L

D

E

E

E

V

I

I

K

A

K

Q

V

G

G

K

E

A

A

I

I

A

A

I

V

K

K

A

G

D

D

S

V

T

T

E

V

P

E

E

S

A

D

I

V

R

I

R

N

A

L

I

V

R

Q

E

S

T

A

K

I

A

K

H

E

L

F

G

G

G

K

L

L

D

D

I

V

V

M

V

I

N

N

A

A

G

G

I

L

L
x
E

I

N

W

P

D

V

S

S

I

S

E

H

N

E

L

M

T

S

L

L

E

S

D
|
D

W

W

E

N

R

K

I
x
V

V

I

N

D

T

T

N

N

V

L

R

T

S

G

V

A

F

F

V

L

A

G

S

S

Q

R

E

E

A

A

A

I

L

K

H

Y

M

F

-

V

-
x
E

N

N

D

D

-

I

G

K

G

G

R

T

I

V

I

I

N

N

I

M

G

S

S

S

T

V

N

H

A

-

E

E

R

K

I

I

P

P

F

W

V

P

G

L

G

F

A

V

I

H

Y

Y

G

A

M

A

S

S

K

K

S

G

A

G

L

M

V

K

G

L

L

M

A

T

K

E

G

T

L

L

A

A

R

L

D

E

L

Y

G

A

P

P

R

K

A

G

I

I

T

R

V
|
V

N

N

I

I

Q

G

P

P

G

G

P

A

V

I

D

N

T

T

D
x
P

M

I

N

N

P

A

D

E

N

K

G

F

D

A

S

D

S

P

E

E

P

Q

-

R

-

A

-

D

I

V

K
x
E

A

S

I

M

G

I

V

P

L

M

G

G

R
x
Y

Y

I

G

G

K

E

A

P

E

E

I

I

A

A

S

A

F

V

V

A

A

A

F

W

I

L

A

A

G

S

P

S

E

E

A

A

G

S

Y

Y

I

V

T

T

G

G

A

I

S

T

L

L

M

F

I

A

D

D

G

G

F

M

S

T

11:35 (vs. 18:42, 36% identical) binding
E96 (≠ L103) mutation E->A,G,K: Heat stable.
D108 (= D115) mutation to N: Heat stable.
V112 (≠ I119) mutation to A: Heat stable.
E133 (vs. gap) mutation to K: Heat stable.
V183 (= V188) mutation to I: Heat stable.
P194 (≠ D199) mutation to Q: Heat stable.
E210 (≠ K212) mutation to K: Heat stable.
Y217 (≠ R219) mutation to H: Heat stable.

Sites not aligning to the query:

252 Q→L: Heat stable.
253 Y→C: Heat stable.
258 A→G: Heat stable.

P0AEK2 3-oxoacyl-[acyl-carrier-protein] reductase FabG; 3-ketoacyl-acyl carrier protein reductase; Beta-Ketoacyl-acyl carrier protein reductase; Beta-ketoacyl-ACP reductase; EC 1.1.1.100 from Escherichia coli (strain K12) (see 2 papers)
39% identity, 95% coverage: 11:252/254 of query aligns to 2:241/244 of P0AEK2

query
sites
P0AEK2

N

N

L

F

Q

E

G

G

K

K

V

I

A

A

F

L

V

V

Q

T

G
|
G

G
x
A

S
|
S

R
|
R

G

G

I

I

G

G

A

R

A

A

I

I

V

A

K

E

R

T

L

L

A

A

S

A

E

R

G

G

A

A

A

K

V

V

A

I

F

G

T

T

Y

-

V

A

S
x
T

S

S

E

E

A

N

Q

G

S

A

Q

Q

L

A

L

I

V

S

D

D

E

Y

V

L

I

G

A

A

Q

N

G

G

G

K

K

-

A

-

I

-

A

G

I

L

K

M

A

L

D
x
N

S
x
V

T

T

E

D

P

P

E

A

A

S

I

I

R

E

R

S

A

V

I

L

R

E

E

K

T

I

K

R

A

A

H

E

L

F

G

G

G

E

L

V

D

D

I

I

V

L

V

V

N

N

N
|
N

A

A

G

G

I

I

L

T

I

R

W

D

D

N

S

L

I

L

E

M

N

R

L

M

T

K

L

D

E

E

D

E

W

W

E

N

R

D

I

I

V

I

N

E

T

T

N

N

V

L

R

S

S

S

V

V

F

F

V

R

A

L

S

S

Q

K

E

A

A

V

-

M

-

R

A

A

L

M

H

M

M

K

N

K

D

R

G

H

G

G

R

R

I

I

N

T

I

I

G

G

S

S

T

V

N

-

A

V

E

G

R

T

I

M

P

G

F

N

V

G

G

G

G

Q

A

A

I

N

Y
|
Y

G
x
A

M
x
A

S
x
A

K
|
K

S

A

A

G

L

L

V

I

G

G

L

F

A

S

K

K

G

S

L

L

A

A

R

R

D

E

L

V

G

A

P

S

R

R

A

G

I

I

T

T

V

V

N

N

N

V

I

V

Q

A

P

P

G

G

P

F

V
x
I

D

E

T

T

D

D

M

M

N

T

P

R

D

A

N

L

G

S

D

D

S

D

S

Q

E

R

P

A

I

-

K

-

A

-

I

-

G

G

V

I

L

L

-

A

-

Q

-

V

-

P

-

A

G

G

R

R

Y

L

G

G

K

G

A

A

E

Q

E

E

I

I

A

A

S

N

F

A

V

V

A

A

F

F

I

L

A

A

G

S

P

D

E

E

A

A

G

A

Y

Y

I

I

T

T

G

G

A
x
E

S

T

L

L

M

H

I

V

D

N

G

G

F

M

GASR 12:15 (≠ GGSR 21:24) binding
T37 (≠ S47) binding
NV 59:60 (≠ DS 72:73) binding
N86 (= N99) binding
Y151 (= Y163) mutation to F: Defect in the affinity for NADPH.
YAAAK 151:155 (≠ YGMSK 163:167) binding
A154 (≠ S166) mutation to T: Decreases in the thermolability of the reductase; when associated with K-233.
K155 (= K167) mutation to A: Defect in the affinity for NADPH.
I184 (≠ V196) binding
E233 (≠ A244) mutation to K: Decreases in the thermolability of the reductase; when associated with T-154.

1q7bA The structure of betaketoacyl-[acp] reductase from e. Coli in complex with NADP+ (see paper)
39% identity, 95% coverage: 11:252/254 of query aligns to 1:240/243 of 1q7bA

query
sites
1q7bA

N

N

L

F

Q

E

G

G

K

K

V

I

A

A

F

L

V

V

Q

T

G
|
G

G

A

S
|
S

R
|
R

G
|
G

I
|
I

G

G

A

R

A

A

I

I

V

A

K

E

R

T

L

L

A

A

S

A

E

R

G

G

A

A

A

K

V

V

A

I

F

G

T

T

Y

-

V
x
A

S
x
T

S

S

E

E

A

N

Q

G

S

A

Q

Q

L

A

L

I

V

S

D

D

E

Y

V

L

I

G

A

A

Q

N

G

G

G

K

K

-

A

-

I

-

A

G

I

L

K

M

A
x
L

D
x
N

S
x
V

T

T

E

D

P

P

E

A

A

S

I

I

R

E

R

S

A

V

I

L

R

E

E

K

T

I

K

R

A

A

H

E

L

F

G

G

G

E

L

V

D

D

I

I

V

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I
|
I

L

T

I

R

W

D

D

N

S

L

I

L

E

M

N

R

L

M

T

K

L

D

E

E

D
x
E

W

W

E

N

R

D

I

I

V

I

N

E

T
|
T

N

N

V

L

R

S

S

S

V

V

F

F

V

R

A

L

S

S

Q

K

E

A

A

V

-

M

-

R

A

A

L

M

H

M

M

K

N

K

D

R

G

H

G

G

R

R

I

I

N

T

I
|
I

G
|
G

S
|
S

T

V

N

-

A

V

E

G

R

T

I

M

P

G

F

N

V

G

G

G

G
x
Q

A

A

I

N

Y
|
Y

G

A

M

A

S

A

K
|
K

S

A

A

G

L

L

V

I

G

G

L

F

A

S

K

K

G

S

L

L

A

A

R

R

D

E

L

V

G

A

P

S

R

R

A

G

I

I

T

T

V

V

N

N

N

V

I

V

Q

A

P
|
P

G
|
G

P
x
F

V
x
I

D

E

T

T

D

D

M

M

N

T

P

R

D

A

N

L

G

S

D

D

S

D

S

Q

E

R

P

A

I

-

K

-

A

-

I

-

G

G

V

I

L

L

-

A

-

Q

-

V

-

P

-

A

G

G

R

R

Y

L

G

G

K

G

A

A

E

Q

E

E

I

I

A

A

S

N

F

A

V

V

A

A

F

F

I

L

A

A

G

S

P

D

E

E

A

A

G

A

Y

Y

I

I

T

T

G

G

A
x
E

S
x
T

L

L

M

H

I

V

D

N

G

G

F

M

active site: G15 (= G25), E101 (≠ D115), S137 (= S149), Q147 (≠ G160), Y150 (= Y163), K154 (= K167)
binding calcium ion: E232 (≠ A244), T233 (≠ S245)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G11 (= G21), S13 (= S23), R14 (= R24), I16 (= I26), A35 (≠ V46), T36 (≠ S47), L57 (≠ A71), N58 (≠ D72), V59 (≠ S73), N85 (= N99), A86 (= A100), G87 (= G101), I88 (= I102), T108 (= T122), I135 (= I147), G136 (= G148), S137 (= S149), Y150 (= Y163), K154 (= K167), P180 (= P193), G181 (= G194), F182 (≠ P195), I183 (≠ V196)

3osuA Crystal structure of the 3-oxoacyl-acyl carrier protein reductase, fabg, from staphylococcus aureus
36% identity, 94% coverage: 15:252/254 of query aligns to 5:244/246 of 3osuA

query
sites
3osuA

K

K

V

S

A

A

F

L

V

V

Q

T

G

G

G

A

S

S

R

R

G
|
G

I

I

G

G

A

R

A

S

I

I

V

A

K

L

R

Q

L

L

A

A

S

E

E

E

G

G

A

Y

A

N

V

V

A

A

F

V

T

N

Y

Y

V

A

S

G

S

S

E

K

A

E

Q

K

S

A

Q

E

L

A

L

V

V

V

D

E

E

E

V

I

I

K

A

A

Q

K

G

G

G

V

K

D

A

S

I

F

A

A

I

I

K

Q

A

A

D

N

S

V

T

A

E

D

P

A

E

D

A

E

I

V

R

K

R

A

A

M

I

I

R

K

E

E

T

V

K

V

A

S

H

Q

L

F

G

G

G

S

L

L

D

D

I

V

V

L

V

V

N

N

N
|
N

A

A

G

G

I

I

L

T

I

R

W

D

D

N

S

L

I

L

E

M

N

R

L

M

T

K

L

E

E

Q

D

E

W

W

E

D

R

D

I

V

V

I

N

D

T

T

N

N

V

L

R

K

S

G

V

V

F

F

V

N

A

C

S

I

Q

Q

E

K

A

A

A

T

L

P

H

Q

M

M

-

L

-

R

N

Q

D

R

G

S

G

G

R

A

I

I

N

N

I

L

G

S

S
|
S

T

V

N

-

A

V

E

G

R

A

I

V

P

G

F

N

V

P

G

G

G
x
Q

A

A

I

N

Y
|
Y

G

V

M

A

S

T

K
|
K

S

A

A

G

L

V

V

I

G

G

L

L

A

T

K

K

G

S

L

A

A

A

R

R

D

E

L

L

G

A

P

S

R

R

A

G

I

I

T

T

V

V

N

N

N

A

I

V

Q

A

P

P

G

G

P

F

V

I

D

V

T

S

D

D

M

M

N

T

P

D

D

A

N

L

G

S

D

D

S

E

-

L

S

K

E

E

P

Q

I

M

K

L

A

T

I

Q

G

I

V

P

L

L

G

A

R

R

Y

F

G

G

K

Q

A

D

E

T

E

D

I

I

A

A

S

N

F

T

V

V

A

A

F

F

I

L

A

A

G

S

P

D

E

K

A

A

G

K

Y

Y

I

I

T

T

G

G

A

Q

S

T

L

I

M

H

I

V

D

N

G

G