SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing 202143 FitnessBrowser__MR1:202143 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)

1kgzB Crystal structure analysis of the anthranilate phosphoribosyltransferase from erwinia carotovora (current name, pectobacterium carotovorum) (see paper)
54% identity, 96% coverage: 7:339/347 of query aligns to 3:328/330 of 1kgzB

query
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1kgzB

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binding manganese (ii) ion: S92 (= S100), D222 (= D232), E223 (= E233), E223 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: V79 (= V87), G82 (= G90), G83 (= G91), N90 (= N98), I91 (= I99), S92 (= S100), T93 (= T101), K108 (= K116), S118 (= S128)

5nofA Anthranilate phosphoribosyltransferase from thermococcus kodakaraensis (see paper)
39% identity, 97% coverage: 9:346/347 of query aligns to 3:324/325 of 5nofA

query
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5nofA

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binding zinc ion: E48 (= E56), D78 (= D92), E198 (≠ R213), D217 (= D232), E218 (= E233)

4yi7A Anthranilate bound at active site of anthranilate phosphoribosyl transferase from acinetobacter (anprt; trpd)
39% identity, 99% coverage: 5:347/347 of query aligns to 3:331/331 of 4yi7A

query
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4yi7A

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active site: V82 (= V87)
binding 2-aminobenzoic acid: V82 (= V87), G83 (= G88), H110 (= H117), R154 (= R174), G167 (= G187)

2gvqD Anthranilate phosphoribosyl-transferase (trpd) from s. Solfataricus in complex with anthranilate (see paper)
36% identity, 87% coverage: 5:307/347 of query aligns to 2:297/345 of 2gvqD

query
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2gvqD

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P

V

A

T

D

D

F

F

G

G

V

I

P

S

Q

P

A

I

H

P

I

I

S

E

E

K

L

L

E

I

G

V

G

N

E

S

P

A

A

E

H

D

N

S

A

A

L

I

-

K

I

I

T

V

Q

R

Q

A

I

F

L

L

Q

-

G

-

H

-

G

G

C

K

D

D

A

E

H

H

T

V

-

A

H

E

A

F

V

I

A

K

I

I

N

N

A

T

G

A

C

V

A

A

L

L

Y

F

binding 2-aminobenzoic acid: H107 (= H117), G108 (= G118), N109 (= N119), N109 (= N119), Q151 (≠ P161), H154 (= H164), M157 (≠ V167), R164 (= R174), G177 (= G187), P178 (= P188)

P50384 Anthranilate phosphoribosyltransferase; EC 2.4.2.18 from Saccharolobus solfataricus (strain ATCC 35092 / DSM 1617 / JCM 11322 / P2) (Sulfolobus solfataricus) (see 2 papers)
36% identity, 87% coverage: 5:307/347 of query aligns to 2:297/345 of P50384

query
sites
P50384

S

N

I

I

Q

N

P

E

L

I

L

L

D

K

I

K

L

L

F

I

Q

N

G

K

K

S

A

D

L

L

T

E

R

I

E

N

Q

E

T

A

A

E

S

E

L

L

F

A

S

K

V

A

L

I

I

I

Q

R

G

G

E

E

M

V

N

P

E

E

T

I

V

L

M

V

A

S

G

A

M

I

L

L

M

V

A

A

L

L

K

R

I

M

R

K

G

G

E

E

T

S

I

K

E

N

E

E

I

I

S

V

G

G

A

F

A

A

D

R

A

A

M

M

R

R

A

E

A

L

A

A

K

I

P

K

F

I

P

D

Y

V

P

P

E

N

S

A

S

-

R

-

S

-

Q

-

G

-

V

-

I

I

D

D

I

T

V

A

G

G

T

T

G

G

D

D

G

G

F

L

N

G

T
|
T

I

V

N

N

I

V

S

S

T

T

T

A

A

S

A

A

F

I

V

L

A

L

A

S

A

L

A

V

G

N

A

P

K

-

V

V

A

A

K
|
K

H
|
H

G

G

N

N

R

R

S

A

V

V

S

S

S

G

K

K

S

S

G

G

S
|
S

S

A

D

D

L

V

L

L

A

E

Q

A

F

L

G

G

I

Y

D

N

L

I

T

I

M

V

S

P

P

P

E

E

L

R

A

A

S

K

H

E

C

L

L

V

E

N

A

K

L

T

N

N

L

F

C

V

F

F

L

L

F

F

A

A

P

Q

H

Y

Y

Y

H
|
H

G

P

G

A

V

M

K

K

H

N

A

V

V

A

P

N

V

V

R
|
R

Q

K

T

T

L

L

K

G

T

I

R

R

T

T

L

I

F

F

N

N

V

I

L

L

G

G

P

P

L

L

I

T

N

N

P

P

A

A

R

N

P

A

E

K

F

Y

M

Q

L

L

L

M

G

G

V

V

Y

F

S

S

A

K

E

D

L

H

V

L

T

D

P

L

I

L

A

S

R

K

V

S

L

A

Q

Y

A

E

L

L

G

D

T

F

Q

N

R

K

A

I

M

I

V

L

V

V

H

Y

G

G

S

E

-

P

G

G

L

I

D
|
D

E
|
E

V

V

A

S

L

P

H

I

G

G

S

N

T

T

Q

F

V

M

A

K

E

I

L

V

K

S

D

K

G

R

E

G

I

I

I

E

E

E

Y

V

Q

K

L

L

T

N

P

V

A

T

D

D

F

F

G

G

V

I

P

S

Q

P

A

I

H

P

I

I

S

E

E

K

L

L

E

I

G

V

G

N

E

S

P

A

A

E

H

D

N

S

A

A

L

I

-

K

I

I

T

V

Q

R

Q

A

I

F

L

L

Q

-

G

-

H

-

G

G

C

K

D

D

A

E

H

H

T

V

-

A

H

E

A

F

V

I

A

K

I

I

N

N

A

T

G

A

C

V

A

A

L

L

Y

F

T87 (= T96) binding
K106 (= K116) mutation to Q: Affinity for phosphoribosylpyrophosphate is similar to that of the wild-type enzyme and catalytic efficiency dedreases only 10-fold.
H107 (= H117) mutation to A: Limited effect on either affinity for anthranilate and catalytic efficiency. 300-fold decrease of the affinity for anthranilate, whereas catalytic efficiency remains nearly unchanged; when associated with A-178.
S118 (= S128) binding
H154 (= H164) mutation to A: Limited effect on either affinity for anthranilate and catalytic efficiency.
R164 (= R174) mutation to A: Strong decrease of the affinity for anthranilate, although only a moderate 7-fold decrease in catalytic efficiency.
D223 (= D232) mutation to N: Affinity for phosphoribosylpyrophosphate is similar to that of the wild-type enzyme and catalytic efficiency is unchanged.
E224 (= E233) mutation to Q: Affinity for phosphoribosylpyrophosphate is similar to that of the wild-type enzyme and catalytic efficiency is unchanged.

1zxyA Anthranilate phosphoribosyltransferase from sulfolobus solfataricus in complex with prpp and magnesium (see paper)
36% identity, 87% coverage: 5:307/347 of query aligns to 2:297/344 of 1zxyA

query
sites
1zxyA

S

N

I

I

Q

N

P

E

L

I

L

L

D

K

I

K

L

L

F

I

Q

N

G

K

K

S

A

D

L

L

T

E

R

I

E

N

Q

E

T

A

A

E

S

E

L

L

F

A

S

K

V

A

L

I

I

I

Q

R

G

G

E

E

M

V

N

P

E

E

T

I

V

L

M

V

A

S

G

A

M

I

L

L

M

V

A

A

L

L

K

R

I

M

R

K

G

G

E

E

T

S

I

K

E

N

E

E

I

I

S

V

G

G

A

F

A

A

D

R

A

A

M

M

R

R

A

E

A

L

A

A

K

I

P

K

F

I

P

D

Y

V

P

P

E

N

S

A

S

-

R

-

S

-

Q

-

G

-

V

-

I

I

D

D

I

T

V
x
A

G
|
G

T

T

G

G

D
|
D

G

G

F

L

N

G

T
|
T

I

V

N
|
N

I

V

S
|
S

T
|
T

T

A

A

S

A

A

F

I

V

L

A

L

A

S

A

L

A

V

G

N

A

P

K

-

V

V

A

A

K
|
K

H

H

G

G

N

N

R

R

S

A

V

V

S

S

S

G

K

K

S

S

G

G

S
|
S

S

A

D

D

L

V

L

L

A

E

Q

A

F

L

G

G

I

Y

D

N

L

I

T

I

M

V

S

P

P

P

E

E

L

R

A

A

S

K

H

E

C

L

L

V

E

N

A

K

L

T

N

N

L

F

C

V

F

F

L

L

F

F

A

A

P

Q

H

Y

Y

Y

H

H

G

P

G

A

V

M

K

K

H

N

A

V

V

A

P

N

V

V

R

R

Q

K

T

T

L

L

K

G

T

I

R

R

T

T

L

I

F

F

N

N

V

I

L

L

G

G

P

P

L

L

I

T

N

N

P

P

A

A

R

N

P

A

E

K

F

Y

M

Q

L

L

L

M

G

G

V

V

Y

F

S

S

A

K

E

D

L

H

V

L

T

D

P

L

I

L

A

S

R

K

V

S

L

A

Q

Y

A

E

L

L

G

D

T

F

Q

N

R

K

A

I

M

I

V

L

V

V

H

Y

G

G

S

E

-

P

G

G

L

I

D
|
D

E
|
E

V

V

A

S

L

P

H

I

G

G

S

N

T

T

Q

F

V

M

A

K

E

I

L

V

K

S

D

K

G

R

E

G

I

I

I

E

E

E

Y

V

Q

K

L

L

T

N

P

V

A

T

D

D

F

F

G

G

V

I

P

S

Q

P

A

I

H

P

I

I

S

E

E

K

L

L

E

I

G

V

G

N

E

S

P

A

A

E

H

D

N

S

A

A

L

I

-

K

I

I

T

V

Q

R

Q

A

I

F

L

L

Q

-

G

-

H

-

G

G

C

K

D

D

A

E

H

H

T

V

-

A

H

E

A

F

V

I

A

K

I

I

N

N

A

T

G

A

C

V

A

A

L

L

Y

F

binding magnesium ion: D223 (= D232), E224 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: A78 (≠ V87), G79 (= G88), D83 (= D92), T87 (= T96), N89 (= N98), S91 (= S100), T92 (= T101), K106 (= K116), S118 (= S128), D223 (= D232), E224 (= E233)

4zokA Methylsulfonyl-containing inhibitor bound in the substrate capture site of mycobacterium tuberculosis anthranilate phosphoribosyltransferase (anprt; trpd)
34% identity, 98% coverage: 5:344/347 of query aligns to 2:342/342 of 4zokA

query
sites
4zokA

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M

M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G

G

T

T

G

G

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H

H

G

G

N

N

R

R

S
x
A

V
x
A

S

S

S
|
S

K

L

S

S

G
|
G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A

A

P
|
P

H

R

Y

F

H

H

G

P

G

S

V

Y

K
x
R

H

H

A

A

V
x
A

P
x
A

V

V

R

R

Q

R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G

G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D

D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

E

-

W

-

L

-

P

S

A

V

W

K

E

M

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V82 (= V87)
binding 4-methyl-2-{[2-methyl-6-(methylsulfonyl)phenyl]amino}benzoic acid: P156 (= P161), R163 (≠ K168), A166 (≠ V171), A167 (≠ P172)
binding magnesium ion: S95 (= S100), E228 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: G86 (= G91), N93 (= N98), S95 (= S100), T96 (= T101), K111 (= K116), A116 (≠ S121), A117 (≠ V122), S119 (= S124), G122 (= G127)

4zofA Lobenzarit-like inhibitor bound in the active site of mycobacterium tuberculosis anthranilate phosphoribosyltransferase (anprt; trpd)
34% identity, 98% coverage: 5:344/347 of query aligns to 2:342/342 of 4zofA

query
sites
4zofA

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M

M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G
|
G

T

T

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H

H

G
|
G

N
|
N

R

R

S
x
A

V
x
A

S

S

S
|
S

K

L

S

S

G
|
G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A
|
A

P

P

H

R

Y

F

H
|
H

G

P

G

S

V
x
Y

K

R

H

H

A

A

V

A

P

A

V

V

R
|
R

Q

R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G
|
G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

E

-

W

-

L

-

P

S

A

V

W

K

E

M

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V82 (= V87)
binding 2-[(2-carboxy-5-nitrophenyl)amino]-3-methylbenzoic acid: G113 (= G118), N114 (= N119), A155 (= A160), H159 (= H164), Y162 (≠ V167), R169 (= R174), G182 (= G187)
binding magnesium ion: S95 (= S100), D227 (= D232), E228 (= E233), E228 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: G83 (= G88), G85 (= G90), G86 (= G91), N93 (= N98), S95 (= S100), T96 (= T101), K111 (= K116), A116 (≠ S121), A117 (≠ V122), S119 (= S124), G122 (= G127)

4owoA Anthranilate phosphoribosyl transferase from mycobacterium tuberculosis in complex with 6-fluoroanthranilate, prpp and magnesium (see paper)
34% identity, 99% coverage: 2:344/347 of query aligns to 1:347/348 of 4owoA

query
sites
4owoA

S

S

E

V

T

P

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M

M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G
|
G

T
|
T

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H
|
H

G

G

N
|
N

R

R

S
x
A

V
x
A

S
|
S

K

L

S

S

G
|
G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A
|
A

P
|
P

H

R

Y

F

H
|
H

G

P

G

S

V
x
Y

K

R

H

H

A

A

V
x
A

P

A

V

V

R
|
R

Q

R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G
|
G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

R

V

A

K

E

M

W

-

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V84 (= V87)
binding 2-azanyl-6-fluoranyl-benzoic acid: V84 (= V87), G85 (= G88), T86 (= T89), H114 (= H117), N116 (= N119), N116 (= N119), A157 (= A160), P158 (= P161), H161 (= H164), Y164 (≠ V167), A168 (≠ V171), R171 (= R174), G184 (= G187)
binding magnesium ion: S97 (= S100), D229 (= D232), E230 (= E233), E230 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: V84 (= V87), G85 (= G88), G87 (= G90), G88 (= G91), N95 (= N98), S97 (= S100), T98 (= T101), K113 (= K116), A118 (≠ S121), A119 (≠ V122), S120 (= S123), S121 (= S124), G124 (= G127)

P9WFX5 Anthranilate phosphoribosyltransferase; EC 2.4.2.18 from Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv) (see 2 papers)
34% identity, 99% coverage: 2:344/347 of query aligns to 23:369/370 of P9WFX5

query
sites
P9WFX5

S

S

E

V

T

P

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M

M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V

V

G
|
G

T

T

G

G

D

D

G

G

F

V

N

N

T
|
T

I

V

N

N

I

L

S

S

T

T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K

K

H

H

G

G

N

N

R

R

S

A

V

A

S

S

K

L

S

S

G

G

S
x
G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A

A

P

P

H

R

Y

F

H

H

G

P

G

S

V

Y

K

R

H

H

A

A

V

A

P

A

V

V

R

R

Q

R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G

G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D

D

E

E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

R

V

A

K

E

M

W

-

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

G107 (= G88) binding
T115 (= T96) binding
G147 (≠ S128) binding

4n5vA Alternative substrates of mycobacterium tuberculosis anthranilate phosphoribosyl transferase (see paper)
34% identity, 99% coverage: 2:344/347 of query aligns to 1:346/347 of 4n5vA

query
sites
4n5vA

S

S

E

V

T

P

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M

M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G
|
G

T

T

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H
|
H

G
|
G

N
|
N

R

R

S

A

V
x
A

S
|
S

K

L

S

S

G
|
G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A
|
A

P
|
P

H

R

Y

F

H
|
H

G

P

G

S

V
x
Y

K
x
R

H

H

A

A

V
x
A

P

A

V

V

R
|
R

Q

R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G
|
G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

A

V

E

K

W

M

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V84 (= V87)
binding 2-amino-4-fluorobenzoic acid: V84 (= V87), G85 (= G88), H114 (= H117), G115 (= G118), N116 (= N119), A157 (= A160), A157 (= A160), P158 (= P161), H161 (= H164), Y164 (≠ V167), R165 (≠ K168), A168 (≠ V171), R171 (= R174), G184 (= G187)
binding magnesium ion: S97 (= S100), D229 (= D232), E230 (= E233), E230 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: G85 (= G88), G87 (= G90), G88 (= G91), N95 (= N98), S97 (= S100), T98 (= T101), K113 (= K116), A119 (≠ V122), S120 (= S123), S121 (= S124), G124 (= G127)

4owuA Anthranilate phosphoribosyl transferase from mycobacterium tuberculosis in complex with 5-methylanthranilate, prpp and magnesium (see paper)
34% identity, 98% coverage: 5:344/347 of query aligns to 3:346/347 of 4owuA

query
sites
4owuA

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M

M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G
|
G

T

T

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H

H

G

G

N
|
N

R

R

S

A

V
x
A

S

S

S
|
S

K

L

S

S

G
|
G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A

A

P
|
P

H

R

Y

F

H

H

G

P

G

S

V
x
Y

K
x
R

H

H

A

A

V
x
A

P

A

V

V

R

R

Q

R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G

G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

R

V

A

K

E

M

W

-

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V83 (= V87)
binding 2-azanyl-5-methyl-benzoic acid: N115 (= N119), P157 (= P161), Y163 (≠ V167), R164 (≠ K168), A167 (≠ V171)
binding magnesium ion: S96 (= S100), D228 (= D232), E229 (= E233), E229 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: G84 (= G88), G86 (= G90), G87 (= G91), N94 (= N98), S96 (= S100), T97 (= T101), K112 (= K116), A118 (≠ V122), S120 (= S124), G123 (= G127)

4owqA Anthranilate phosphoribosyl transferase from mycobacterium tuberculosis in complex with 3-methylanthranilate, prpp and magnesium (see paper)
34% identity, 98% coverage: 5:344/347 of query aligns to 3:346/347 of 4owqA

query
sites
4owqA

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M

M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G
|
G

T

T

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H

H

G

G

N

N

R

R

S
x
A

V
x
A

S

S

S
|
S

K

L

S

S

G
|
G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A

A

P
|
P

H

R

Y

F

H
|
H

G

P

G

S

V
x
Y

K

R

H

H

A

A

V
x
A

P

A

V

V

R

R

Q
x
R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G

G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

R

V

A

K

E

M

W

-

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V83 (= V87)
binding 2-azanyl-3-methyl-benzoic acid: P157 (= P161), H160 (= H164), Y163 (≠ V167), A167 (≠ V171), R171 (≠ Q175)
binding magnesium ion: S96 (= S100), D228 (= D232), E229 (= E233), E229 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: V83 (= V87), G84 (= G88), G86 (= G90), G87 (= G91), N94 (= N98), S96 (= S100), T97 (= T101), K112 (= K116), A117 (≠ S121), A118 (≠ V122), S120 (= S124), G123 (= G127)

4owmA Anthranilate phosphoribosyl transferase from mycobacterium tuberculosis in complex with 3-fluoroanthranilate, prpp and magnesium (see paper)
34% identity, 98% coverage: 5:344/347 of query aligns to 2:345/346 of 4owmA

query
sites
4owmA

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M

M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G
|
G

T

T

G

G

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H

H

G

G

N

N

R

R

S

A

V
x
A

S
|
S

K

L

S

S

G
|
G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A

A

P
|
P

H

R

Y

F

H
|
H

G

P

G

S

V
x
Y

K
x
R

H

H

A

A

V
x
A

P

A

V

V

R

R

Q
x
R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G

G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

R

V

A

K

E

M

W

-

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V82 (= V87)
binding 2-azanyl-3-fluoranyl-benzoic acid: P156 (= P161), H159 (= H164), Y162 (≠ V167), R163 (≠ K168), A166 (≠ V171), R170 (≠ Q175)
binding magnesium ion: S95 (= S100), D227 (= D232), E228 (= E233), E228 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: G83 (= G88), G86 (= G91), N93 (= N98), S95 (= S100), T96 (= T101), K111 (= K116), A117 (≠ V122), S118 (= S123), S119 (= S124), G122 (= G127)

4gkmA Bianthranilate-like analogue bound in the outer site of anthranilate phosphoribosyltransferase (anprt; trpd) (see paper)
34% identity, 98% coverage: 5:344/347 of query aligns to 2:345/346 of 4gkmA

query
sites
4gkmA

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M

M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G

G

T

T

G

G

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H

H

G

G

N
|
N

R

R

S

A

V
x
A

S
|
S

K

L

S

S

G
|
G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A
|
A

P
|
P

H

R

Y

F

H

H

G

P

G

S

V
x
Y

K
x
R

H

H

A

A

V
x
A

P

A

V

V

R
|
R

Q
x
R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G

G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

R

V

A

K

E

M

W

-

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V82 (= V87)
binding 2-[(2-carboxyphenyl)amino]-5-methylbenzoic acid: N114 (= N119), A155 (= A160), P156 (= P161), Y162 (≠ V167), R163 (≠ K168), A166 (≠ V171), R169 (= R174), R170 (≠ Q175)
binding magnesium ion: S95 (= S100), D227 (= D232), E228 (= E233), E228 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: G86 (= G91), N93 (= N98), S95 (= S100), T96 (= T101), K111 (= K116), A117 (≠ V122), S118 (= S123), S119 (= S124), G122 (= G127)

3r6cA Anthranilate phosphoribosyltransferase (trpd) from mycobacterium tuberculosis (complex with inhibitor acs179) (see paper)
34% identity, 98% coverage: 5:344/347 of query aligns to 2:345/346 of 3r6cA

query
sites
3r6cA

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M
|
M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G
|
G

T

T

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H

H

G

G

N
|
N

R
|
R

S
x
A

V
x
A

S
|
S

K

L

S

S

G
|
G

S
x
G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A
|
A

P
|
P

H

R

Y

F

H
|
H

G

P

G

S

V
x
Y

K

R

H

H

A

A

V
x
A

P

A

V

V

R
|
R

Q

R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G
|
G

P

P

L

L

I
x
T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E
x
R

L

V

K
x
A

D

A

G

G

E

S

I

V

I
x
D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L
x
V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

R

V
x
A

K

E

M
x
W

-

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V82 (= V87)
binding 8-methoxyphenanthro[3,4-d][1,3]dioxole-5,6-dicarboxylic acid: M62 (= M65), N114 (= N119), A155 (= A160), P156 (= P161), H159 (= H164), Y162 (≠ V167), A166 (≠ V171), R169 (= R174), G182 (= G187), T185 (≠ I190), R239 (≠ E244), A241 (≠ K246), D246 (≠ I251), V301 (≠ L306), A310 (≠ V315), W312 (≠ M317)
binding magnesium ion: S95 (= S100), D227 (= D232), E228 (= E233), E228 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: G83 (= G88), G85 (= G90), G86 (= G91), N93 (= N98), S95 (= S100), T96 (= T101), K111 (= K116), N114 (= N119), R115 (= R120), A116 (≠ S121), A117 (≠ V122), S118 (= S123), S119 (= S124), G122 (= G127), G123 (≠ S128)

3qsaA Anthranilate phosphoribosyltransferase (trpd) from mycobacterium tuberculosis (complex with inhibitor tamu-a7)
34% identity, 98% coverage: 5:344/347 of query aligns to 2:345/346 of 3qsaA

query
sites
3qsaA

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M
|
M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G
|
G

T

T

G

G

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H

H

G

G

N
|
N

R

R

S

A

V
x
A

S
|
S

K

L

S

S

G
|
G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A
|
A

P
|
P

H

R

Y

F

H
|
H

G

P

G

S

V
x
Y

K
x
R

H

H

A

A

V
x
A

P

A

V

V

R

R

Q

R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G
|
G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

R

V

A

K

E

M

W

-

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V82 (= V87)
binding magnesium ion: S95 (= S100), D227 (= D232), E228 (= E233), E228 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: G83 (= G88), G86 (= G91), N93 (= N98), S95 (= S100), T96 (= T101), K111 (= K116), A117 (≠ V122), S118 (= S123), S119 (= S124), G122 (= G127)
binding 4,4,4-trifluoro-1-(4-methoxyphenyl)butane-1,3-dione: M62 (= M65), N114 (= N119), A155 (= A160), P156 (= P161), H159 (= H164), Y162 (≠ V167), R163 (≠ K168), A166 (≠ V171), G182 (= G187)

3qs8A Anthranilate phosphoribosyltransferase (trpd) from mycobacterium tuberculosis (complex with inhibitor acs174) (see paper)
34% identity, 98% coverage: 5:344/347 of query aligns to 2:345/346 of 3qs8A

query
sites
3qs8A

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M
|
M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G
|
G

T

T

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H

H

G

G

N
|
N

R

R

S
x
A

V
x
A

S
|
S

K

L

S

S

G
|
G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A
|
A

P
|
P

H

R

Y

F

H

H

G

P

G

S

V
x
Y

K

R

H

H

A

A

V
x
A

P

A

V

V

R
|
R

Q
x
R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L
|
L

G
|
G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

R

V

A

K

E

M

W

-

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V82 (= V87)
binding 2-benzylbenzoic acid: M62 (= M65), G83 (= G88), N114 (= N119), N114 (= N119), A155 (= A160), A155 (= A160), P156 (= P161), Y162 (≠ V167), Y162 (≠ V167), A166 (≠ V171), R169 (= R174), R169 (= R174), R170 (≠ Q175), L181 (= L186), G182 (= G187)
binding magnesium ion: S95 (= S100), D227 (= D232), E228 (= E233), E228 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: G83 (= G88), G85 (= G90), G86 (= G91), N93 (= N98), S95 (= S100), T96 (= T101), K111 (= K116), N114 (= N119), A116 (≠ S121), A117 (≠ V122), S118 (= S123), S119 (= S124), G122 (= G127), E228 (= E233)

3qqsA Anthranilate phosphoribosyltransferase (trpd) from mycobacterium tuberculosis (complex with inhibitor acs172) (see paper)
34% identity, 98% coverage: 5:344/347 of query aligns to 2:345/346 of 3qqsA

query
sites
3qqsA

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K

T

I

M

R

K

G

A

E

P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M

M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G

G

T

T

G
|
G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K
|
K

H

H

G

G

N

N

R
|
R

S

A

V
x
A

S
|
S

K

L

S

S

G
|
G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A

A

P
|
P

H

R

Y

F

H
|
H

G

P

G

S

V
x
Y

K
x
R

H

H

A

A

V
x
A

P

A

V

V

R
|
R

Q
x
R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G

G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E

D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

R

V

A

K

E

M

W

-

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V82 (= V87)
binding 2,2'-iminodibenzoic acid: P156 (= P161), H159 (= H164), Y162 (≠ V167), R163 (≠ K168), A166 (≠ V171), R169 (= R174), R170 (≠ Q175)
binding magnesium ion: S95 (= S100), D227 (= D232), E228 (= E233), E228 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: V82 (= V87), G85 (= G90), G86 (= G91), N93 (= N98), S95 (= S100), T96 (= T101), K111 (= K116), R115 (= R120), A117 (≠ V122), S118 (= S123), S119 (= S124), G122 (= G127)

1zvwA The crystal structure of trpd (rv2192c) from mycobacterium tuberculosis in complex with prpp and magnesium (see paper)
34% identity, 98% coverage: 5:344/347 of query aligns to 2:345/346 of 1zvwA

query
sites
1zvwA

S

S

I

W

Q

P

P

Q

L

I

L

L

D

G

I

R

L

L

F

T

Q

D

G

N

K

R

A

D

L

L

T

A

R

R

E

G

Q

Q

T

A

A

A

S

W

L

A

F

M

S

D

V

Q

L

I

I

M

Q

T

G

G

E

N

M

A

N

R

E

P

T

A

V

Q

M

I

A

A

G

A

M

F

L

A

M

V

A

A

L

M

K
x
T

I
x
M

R
x
K

G

A

E
x
P

T

T

I

A

E

D

E

E

I

V

S

G

G

E

A

L

A

A

D

G

A

V

M

M

R

L

A

S

A

H

A

A

K

H

P

P

F

L

P

P

Y

-

P

-

E

A

S

D

S

T

R

V

S

P

Q

D

G

D

V

A

I

V

D

D

I

V

V
|
V

G
|
G

T

T

G

G

D

D

G

G

F

V

N

N

T

T

I

V

N
|
N

I

L

S
|
S

T
|
T

T

M

A

A

F

I

V

V

A

V

A

A

G

G

A

V

K

P

V

V

A

V

K

K

H

H

G

G

N

N

R

R

S

A

V
x
A

S
|
S

K

L

S

S

G

G

S

G

S

A

D

D

L

T

L

L

A

E

Q

A

F

L

G

G

I

V

D

R

L

I

T

D

M

L

S

G

P

P

E

D

L

L

A

V

S

A

H

R

C

S

L

L

E

A

A

E

L

V

N

G

L

I

C

G

F

F

L

C

F

F

A

A

P

P

H

R

Y

F

H

H

G

P

G

S

V

Y

K

R

H

H

A

A

V

A

P

A

V

V

R

R

Q

R

T

E

L

I

K

G

T

V

R

P

T

T

L

V

F

F

N

N

V

L

L

L

G

G

P

P

L

L

I

T

N

N

P

P

A

A

R

R

P

P

E

R

F

A

M

G

L

L

L

I

G

G

V

C

Y

A

S

F

A

A

E
x
D

L

L

V

A

T

E

P

V

I

M

A

A

R

G

V

V

L

F

Q

A

A

A

L

R

G

R

T

S

Q

S

R

-

A

V

M

L

V

V

H

H

G

G

-

D

S

D

G

G

L

L

D
|
D

E
|
E

V

L

A

T

L

T

H

T

G

T

S

T

T

S

Q

T

V

I

A

W

E

R

L

V

K

A

D

A

G

G

E

S

I

V

I

D

E

K

Y

L

Q

T

L

F

T

D

P

P

A

A

D

G

F

F

G

G

V

F

P

A

Q

R

A

A

H

Q

I

L

S

D

E

Q

L

L

E

A

G

G

E

D

P

A

A

Q

H

A

N

N

A

A

L

A

I

A

T

V

Q

R

Q

A

I

V

L

L

Q

G

G

G

H

A

G

R

C

G

D

P

A

V

H

R

T

D

H

A

A

V

V

V

A

L

I

N

N

A

A

A

G

G

C

A

A

I

L

V

Y

A

L

H

C

A

G

G

L

L

S

S

E

S

S

R

V

A

K

E

M

W

-

L

-

P

-

A

-

W

-

E

G

G

T

L

A

R

L

R

A

A

L

S

S

A

T

A

I

I

K

D

T

T

G

G

K

A

A

A

Y

E

E

Q

L

L

H

A

K

R

L

W

A

V

T

R

V

F

S

G

S

R

Q

Q

active site: V82 (= V87)
binding benzamidine: T46 (≠ K49), M47 (≠ I50), K48 (≠ R51), P50 (≠ E53), D201 (≠ E206)
binding magnesium ion: S95 (= S100), D227 (= D232), E228 (= E233), E228 (= E233)
binding 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose: G83 (= G88), N93 (= N98), S95 (= S100), T96 (= T101), A117 (≠ V122), S118 (= S123), S119 (= S124)

Query Sequence

>202143 FitnessBrowser__MR1:202143
MSETSIQPLLDILFQGKALTREQTASLFSVLIQGEMNETVMAGMLMALKIRGETIEEISG
AADAMRAAAKPFPYPESSRSQGVIDIVGTGGDGFNTINISTTAAFVAAAAGAKVAKHGNR
SVSSKSGSSDLLAQFGIDLTMSPELASHCLEALNLCFLFAPHYHGGVKHAVPVRQTLKTR
TLFNVLGPLINPARPEFMLLGVYSAELVTPIARVLQALGTQRAMVVHGSGLDEVALHGST
QVAELKDGEIIEYQLTPADFGVPQAHISELEGGEPAHNALITQQILQGHGCDAHTHAVAI
NAGCALYLCGLSESVKMGTALALSTIKTGKAYELLHKLATVSSQSQE

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