SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing WP_075860264.1 NCBI__GCF_001950255.1:WP_075860264.1 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)

Q9HTN2 Acetylglutamate kinase; N-acetyl-L-glutamate 5-phosphotransferase; NAG kinase; NAGK; EC 2.7.2.8 from Pseudomonas aeruginosa (strain ATCC 15692 / DSM 22644 / CIP 104116 / JCM 14847 / LMG 12228 / 1C / PRS 101 / PAO1) (see 2 papers)
56% identity, 97% coverage: 9:293/294 of query aligns to 13:296/301 of Q9HTN2

query
sites
Q9HTN2

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R90 (= R86) binding substrate
N195 (= N189) binding substrate

Sites not aligning to the query:

1 modified: Initiator methionine, Removed

2bufC Arginine feed-back inhibitable acetylglutamate kinase (see paper)
56% identity, 97% coverage: 9:293/294 of query aligns to 12:295/298 of 2bufC

query
sites
2bufC

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active site: K32 (= K29), G35 (= G32), G68 (= G65), D198 (= D193), K254 (= K252)
binding adenosine-5'-diphosphate: N36 (≠ H33), N218 (≠ D213), L222 (≠ I217), M223 (≠ L218), T246 (≠ V244), I247 (= I245), Y248 (≠ R246), G250 (= G248), M251 (= M249)

2v5hB Controlling the storage of nitrogen as arginine: the complex of pii and acetylglutamate kinase from synechococcus elongatus pcc 7942 (see paper)
52% identity, 98% coverage: 6:292/294 of query aligns to 5:281/289 of 2v5hB

query
sites
2v5hB

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active site: K28 (= K29), G31 (= G32), G64 (= G65), D182 (= D193), K241 (= K252)
binding n-acetyl-l-glutamate: G62 (= G63), R85 (= R86), N178 (= N189), A181 (= A192)

2bufA Arginine feed-back inhibitable acetylglutamate kinase (see paper)
55% identity, 97% coverage: 9:293/294 of query aligns to 12:287/292 of 2bufA

query
sites
2bufA

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active site: K32 (= K29), G35 (= G32), G68 (= G65), D190 (= D193), K246 (= K252)
binding n-acetyl-l-glutamate: G66 (= G63), G67 (= G64), R89 (= R86), N186 (= N189), A189 (= A192)

2btyA Acetylglutamate kinase from thermotoga maritima complexed with its inhibitor arginine (see paper)
53% identity, 98% coverage: 5:292/294 of query aligns to 3:277/282 of 2btyA

query
sites
2btyA

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M

L

N

I

L

E

N

K

L

A

H

G

G

K

R

A

A

V

V

G

G

L

I

S

C

G

G

K

K

D

D

A

S

G

K

L

L

I

I

K

V

A

A

H

E

K

K

K

E

L

-

A

-

K

-

N

-

P

-

E

-

P

-

T

-

G

-

E

T

E

K

Y

H

L

G

D

D

L

I

G

G

Y

Y

V

V

G

G

E

K

I

V

S

K

E

K

V

V

N

N

P

P

E

E

I

I

L

L

L

H

T

A

L

L

I

I

D

E

K

N

G

D

Y

Y

I

I

P

P

V

V

V

I

A

A

P

P

V

V

G

G

S

I

N

G

G

E

S

D

G

G

E

H

F

S

Y

Y

N

N

I

I

N
|
N

A

A

D
|
D

E

T

V

A

A

A

E

E

V

I

A

A

V

K

A

S

L

L

K

M

A

A

D

E

K
|
K

L

L

I

I

V

L

L

L

T

T

D

D

T

V

P

D

G

G

I

V

L

L

L

K

N

D

E

G

K

K

D

-

E

-

N

-

S

-

L

L

L

I

S
|
S

K

T

A

L

S

T

I

P

A

D

E

E

V

A

K

E

E

E

L

L

I

I

N

R

R

D

G

G

V

T

I

V

R

T

G

G

M

M

I

I

P

P

K
|
K

A

V

E

E

S

C

A

A

I

V

S

S

A

A

I

V

K

R

R

G

G

G

V

V

G

G

S

A

V

V

H

H

I

I

D

N

G

G

R

G

I

L

A

E

H

H

S

A

L

I

L

L

E
|
E

I
|
I

F

F

T

S

D
x
R

A
x
K

G

G

V

I

G
|
G

T

T

M
|
M

L

I

active site: K27 (= K29), G30 (= G32), G63 (= G65), D182 (= D193), K237 (= K252)
binding arginine: Y15 (= Y17), F19 (= F21), K196 (= K207), S214 (= S229), E266 (= E281), I267 (= I282), R270 (≠ D285), K271 (≠ A286), G274 (= G289), M276 (= M291)
binding n-acetyl-l-glutamate: G29 (= G31), G30 (= G32), G61 (= G63), G62 (= G64), N180 (= N191), D182 (= D193)

Q9X2A4 Acetylglutamate kinase; N-acetyl-L-glutamate 5-phosphotransferase; NAG kinase; NAGK; EC 2.7.2.8 from Thermotoga maritima (strain ATCC 43589 / DSM 3109 / JCM 10099 / NBRC 100826 / MSB8) (see paper)
53% identity, 98% coverage: 5:292/294 of query aligns to 3:277/282 of Q9X2A4

query
sites
Q9X2A4

L

I

E

D

K

T

T

V

K

N

V

V

L

L

I

L

E

E

A

A

L

L

P

P

Y

Y

I

I

K

K

K

E

F

F

Y

Y

G

G

K

K

T

T

I

F

V

V

I

I

K

K

Y

F

G

G

H

S

A

A

M

M

V

K

S

Q

D

E

Q

N

L

A

K

K

E

K

A

A

V

F

I

I

N

Q

D

D

L

I

V

I

L

L

M

L

K

K

F

Y

V

T

G

G

I

I

N

K

P

P

V

I

V

V

H

H

G

G

P

P

E

A

I

I

S

S

R

Q

M

M

L

M

N

K

K

D

L

L

N

G

I

I

K

E

S

P

N

V

F

F

I

K

N

N

G

G

L

H

R

R

V

V

T

T

D

D

E

E

A

K

T

T

L

M

E

E

V

I

V

V

E

E

M

M

V

V

L

L

V

V

G

G

K

K

V

I

N

N

K

K

E

E

I

I

V

V

G

M

L

N

I

L

E

N

K

L

A

H

G

G

K

R

A

A

V

V

G

G

L

I

S

C

G

G

K

K

D

D

A

S

G

K

L

L

I

I

K

V

A

A

H

E

K

K

K

E

L

-

A

-

K

-

N

-

P

-

E

-

P

-

T

-

G

-

E

T

E

K

Y

H

L

G

D

D

L

I

G

G

Y

Y

V

V

G

G

E

K

I

V

S

K

E

K

V

V

N

N

P

P

E

E

I

I

L

L

L

H

T

A

L

L

I

I

D

E

K

N

G

D

Y

Y

I

I

P

P

V

V

V

I

A

A

P

P

V

V

G

G

S

I

N

G

G

E

S

D

G

G

E

H

F

S

Y

Y

N
|
N

I

I

N

N

A

A

D

D

E

T

V

A

A

A

E

E

V

I

A

A

V

K

A

S

L

L

K

M

A

A

D

E

K
|
K

L

L

I

I

V

L

L

L

T

T

D

D

T

V

P

D

G

G

I

V

L

L

L

K

N

D

E

G

K

K

D

-

E

-

N

-

S

-

L

L

L

I

S
|
S

K

T

A

L

S

T

I

P

A

D

E

E

V

A

K

E

E

E

L

L

I

I

N

R

R

D

G

G

V

T

I

V

R

T

G

G

M

M

I

I

P

P

K

K

A

V

E

E

S

C

A

A

I

V

S

S

A

A

I

V

K

R

R

G

G

G

V

V

G

G

S

A

V

V

H

H

I

I

D

N

G

G

R

G

I

L

A

E

H

H

S

A

L

I

L

L

E
|
E

I
|
I

F
|
F

T
x
S

D

R

A

K

G

G

V

I

G

G

T

T

M

M

L

I

N178 (= N189) binding substrate
K196 (= K207) binding L-arginine
S214 (= S229) binding L-arginine
EIFS 266:269 (≠ EIFT 281:284) binding L-arginine

Q9SCL7 Acetylglutamate kinase, chloroplastic; N-acetyl-L-glutamate 5-phosphotransferase; NAG kinase; AtNAGK; EC 2.7.2.8 from Arabidopsis thaliana (Mouse-ear cress) (see 3 papers)
53% identity, 98% coverage: 7:293/294 of query aligns to 69:346/347 of Q9SCL7

query
sites
Q9SCL7

K

R

T

V

K

E

V

I

L

L

I

S

E

E

A

S

L

L

P

P

Y

F

I

I

K

Q

K

K

F

F

Y

R

G

G

K

K

T

T

I

I

V

V

I

V

K

K

Y

Y

G

G

G
|
G

H
x
A

A

A

M

M

V

T

S

S

D

P

Q

E

L

L

K

K

E

S

A

S

V

V

I

V

N

S

D

D

L

L

V

V

L

L

M

L

K

A

F

C

V

V

G

G

I

L

N

R

P

P

V

I

V

L

V

V

H

H

G

G

G
|
G

G

G

P

P

E

D

I

I

S

N

R

R

M

Y

L

L

N

K

K

Q

L

L

N

N

I

I

K

P

S

A

N

E

F

F

I

R

N

D

G

G

L

L

R
|
R

V

V

T

T

D

D

E

A

A

T

T

T

L

M

E

E

V

I

V

V

E

S

M

M

V

V

L

L

V

V

G

G

K

K

V

V

N

N

K

K

E

N

I

L

V

V

G

S

L

L

I

I

E

N

K

A

A

A

G

G

G

A

K

T

A

A

V

V

G

G

L

L

S

S

G

G

K

H

D

D

A

G

G

R

L

L

I

L

K

T

A

A

H

R

K

-

L

-

A

-

K

-

N

-

P

P

E

V

P

P

T

N

G

S

E

A

E

Q

Y

-

L

-

D

-

L

L

G

G

Y

F

V

V

G

G

E

E

I

V

S

A

E

R

V

V

N

D

P

P

E

S

I

V

L

L

L

R

T

P

L

L

I

V

D

D

K

Y

G

G

Y

Y

I

I

P

P

V

V

V

I

A

A

P

S

V

V

G

A

S

A

N

D

G

D

S

S

G

G

E

Q

F

A

Y

Y

N
|
N

I
|
I

N
|
N

A
|
A

D

D

E

T

V

V

A

A

A

G

E

E

V

L

A

A

V

A

A

A

L

L

K

G

A

A

D

E

K
|
K

L

L

I

I

V

L

L

L

T
|
T

D
|
D

T

V

P

A

G

G

I

I

L
|
L

L

E

N

N

E

K

K

E

D

D

E

P

N

S

S

S

L

L

L

I

S
x
K

K

E

A

I

S

D

I

I

A

K

E

G

V

V

K

K

E

K

L

M

I

I

N

E

R

D

G

G

V
x
K

I
x
V

R
x
A

G
|
G

M
|
M

I
|
I

P
|
P

K
|
K

A

V

E

K

S

C

A

C

I

I

S

R

A

S

I

L

K

A

R

Q

G

G

V

V

G

K

S

T

V

A

H

S

I

I

D

D

G

G

R

R

I

R

A

Q

H

H

S

S

L

L

L

H

E
|
E

I
|
I

F
x
M

T
x
S

D

D

A

E

G

G

V

A

G
|
G

T

T

M

M

L

I

T

T

GA 94:95 (≠ GH 32:33) binding ATP
G126 (= G64) binding N-acetyl-L-glutamate
R148 (= R86) binding N-acetyl-L-glutamate
NINA 242:245 (= NINA 189:192) binding N-acetyl-L-glutamate
K260 (= K207) binding L-arginine
TD 265:266 (= TD 212:213) binding ATP
L271 (= L218) binding ATP
K282 (≠ S229) binding L-arginine
297:305 (vs. 244:252, 67% identical) binding ATP
EIMS 334:337 (≠ EIFT 281:284) binding L-arginine
G342 (= G289) binding L-arginine

Sites not aligning to the query:

1:50 modified: transit peptide, Chloroplast

4usjB N-acetylglutamate kinase from arabidopsis thaliana in complex with pii from chlamydomonas reinhardtii (see paper)
53% identity, 98% coverage: 7:293/294 of query aligns to 3:280/281 of 4usjB

query
sites
4usjB

K

R

T

V

K

E

V

I

L

L

I

S

E

E

A

S

L

L

P

P

Y

F

I

I

K

Q

K

K

F
|
F

Y

R

G

G

K

K

T

T

I

I

V

V

I

V

K
|
K

Y

Y

G

G

G
|
G

H

A

A

A

M

M

V

T

S

S

D

P

Q

E

L

L

K

K

E

S

A

S

V

V

I

V

N

S

D

D

L

L

V

V

L

L

M

L

K

A

F

C

V

V

G

G

I

L

N

R

P

P

V

I

V

L

V

V

H

H

G
|
G

P

P

E

D

I

I

S

N

R

R

M

Y

L

L

N

K

K

Q

L

L

N

N

I

I

K

P

S

A

N

E

F

F

I

R

N

D

G

G

L

L

R
|
R

V

V

T

T

D

D

E

A

A

T

T

T

L

M

E

E

V

I

V

V

E

S

M

M

V

V

L

L

V

V

G

G

K

K

V

V

N

N

K

K

E

N

I

L

V

V

G

S

L

L

I

I

E

N

K

A

A

A

G

G

G

A

K

T

A

A

V

V

G

G

L

L

S

S

G

G

K

H

D

D

A

G

G

R

L

L

I

L

K

T

A

A

H

R

K

-

L

-

A

-

K

-

N

-

P

P

E

V

P

P

T

N

G

S

E

A

E

Q

Y

-

L

-

D

-

L

L

G

G

Y

F

V

V

G

G

E

E

I

V

S

A

E

R

V

V

N

D

P

P

E

S

I

V

L

L

L

R

T

P

L

L

I

V

D

D

K

Y

G

G

Y

Y

I

I

P

P

V

V

V

I

A

A

P

S

V

V

G

A

S

A

N

D

G

D

S

S

G

G

E

Q

F

A

Y

Y

N
|
N

I

I

N

N

A
|
A

D
|
D

E

T

V

V

A

A

A

G

E

E

V

L

A

A

V

A

A

A

L

L

K

G

A

A

D

E

K
|
K

L

L

I

I

V

L

L

L

T

T

D

D

T

V

P

A

G

G

I

I

L

L

L

E

N

N

E

K

K

E

D

D

E

P

N

S

S

S

L

L

L

I

S
x
K

K

E

A

I

S

D

I

I

A

K

E

G

V

V

K

K

E

K

L

M

I

I

N

E

R

D

G

G

V

K

I

V

R

A

G

G

M

M

I

I

P

P

K
|
K

A

V

E

K

S

C

A

C

I

I

S

R

A

S

I

L

K

A

R

Q

G

G

V

V

G

K

S

T

V

A

H

S

I

I

D

D

G

G

R

R

I

R

A

Q

H

H

S

S

L

L

L

H

E
|
E

I
|
I

F

M

T
x
S

D

D

A
x
E

G
|
G

V

A

G

G

T

T

M
|
M

L

I

T

T

active site: K25 (= K29), G28 (= G32), G61 (= G65), D180 (= D193), K239 (= K252)
binding arginine: F17 (= F21), K194 (= K207), K216 (≠ S229), E268 (= E281), I269 (= I282), S271 (≠ T284), E273 (≠ A286), G274 (= G287), M278 (= M291)
binding n-acetyl-l-glutamyl 5-phosphate: G59 (= G63), G60 (= G64), G61 (= G65), R82 (= R86), N176 (= N189), A179 (= A192)

2rd5B Structural basis for the regulation of n-acetylglutamate kinase by pii in arabidopsis thaliana (see paper)
53% identity, 98% coverage: 7:293/294 of query aligns to 5:282/283 of 2rd5B

query
sites
2rd5B

K

R

T

V

K

E

V

I

L

L

I

S

E

E

A

S

L

L

P

P

Y

F

I

I

K

Q

K

K

F

F

Y

R

G

G

K

K

T

T

I

I

V

V

I

V

K
|
K

Y

Y

G

G

G
|
G

H
x
A

A

A

M

M

V

T

S

S

D

P

Q

E

L

L

K

K

E

S

A

S

V

V

I

V

N

S

D

D

L

L

V

V

L

L

M

L

K

A

F

C

V

V

G

G

I

L

N

R

P

P

V

I

V

L

V

V

H

H

G
|
G

G

G

G
|
G

P

P

E

D

I

I

S

N

R

R

M

Y

L

L

N

K

K

Q

L

L

N

N

I

I

K

P

S

A

N

E

F

F

I

R

N

D

G

G

L

L

R
|
R

V

V

T

T

D

D

E

A

A

T

T

T

L

M

E

E

V

I

V

V

E

S

M

M

V

V

L

L

V

V

G

G

K

K

V

V

N

N

K

K

E

N

I

L

V

V

G

S

L

L

I

I

E

N

K

A

A

A

G

G

G

A

K

T

A

A

V

V

G

G

L

L

S

S

G

G

K

H

D

D

A

G

G

R

L

L

I

L

K

T

A

A

H

R

K

-

L

-

A

-

K

-

N

-

P

P

E

V

P

P

T

N

G

S

E

A

E

Q

Y

-

L

-

D

-

L

L

G

G

Y

F

V

V

G

G

E

E

I

V

S

A

E

R

V

V

N

D

P

P

E

S

I

V

L

L

L

R

T

P

L

L

I

V

D

D

K

Y

G

G

Y

Y

I

I

P

P

V

V

V

I

A

A

P

S

V

V

G

A

S

A

N

D

G

D

S

S

G

G

E

Q

F

A

Y

Y

N
|
N

I

I

N
|
N

A
|
A

D
|
D

E

T

V

V

A

A

A

G

E

E

V

L

A

A

V

A

A

A

L

L

K

G

A

A

D

E

K
|
K

L

L

I

I

V

L

L

L

T
|
T

D
|
D

T

V

P

A

G

G

I

I

L
|
L

L

E

N

N

E
x
K

K

E

D

D

E

P

N

S

S

S

L

L

L

I

S
x
K

K

E

A

I

S

D

I

I

A

K

E

G

V

V

K

K

E

K

L

M

I

I

N

E

R

D

G

G

V

K

I

V

R
x
A

G

G

G
|
G

M
|
M

I

I

P

P

K
|
K

A

V

E

K

S

C

A

C

I

I

S

R

A

S

I

L

K

A

R

Q

G

G

V

V

G

K

S

T

V

A

H

S

I

I

D

D

G

G

R

R

I

R

A

Q

H

H

S

S

L

L

L

H

E
|
E

I

I

F

M

T
x
S

D

D

A
x
E

G

G

V

A

G
|
G

T

T

M
|
M

L

I

T

T

active site: K27 (= K29), G30 (= G32), G63 (= G65), D182 (= D193), K241 (= K252)
binding adenosine-5'-diphosphate: A31 (≠ H33), T201 (= T212), D202 (= D213), L207 (= L218), K210 (≠ E221), A235 (≠ R246), G237 (= G248), M238 (= M249), K241 (= K252)
binding arginine: K196 (= K207), K218 (≠ S229), E270 (= E281), S273 (≠ T284), E275 (≠ A286), G278 (= G289), M280 (= M291)
binding n-acetyl-l-glutamate: G61 (= G63), R84 (= R86), N178 (= N189), N180 (= N191), A181 (= A192)

2bufK Arginine feed-back inhibitable acetylglutamate kinase (see paper)
53% identity, 97% coverage: 9:293/294 of query aligns to 12:272/273 of 2bufK

query
sites
2bufK

K

K

V

V

L

L

I

S

E

E

A

A

L

L

P

P

Y

Y

I

I

K

R

F

F

Y

V

G

G

K

K

T

T

I

L

V

V

I

I

K
|
K

Y

Y

G

G

G
|
G

H

N

A

A

M

M

V

E

S

S

D

E

Q

E

L

L

K

K

E

A

A

G

V

F

I

A

N

R

D

D

L

V

V

V

L

L

M

M

K

K

F

A

V

V

G

G

I

I

N

N

P

P

V

V

H

H

G

G

G
|
G

P

P

E

Q

I

I

S

G

R

D

M

L

L

L

N

K

K

R

L

L

N

S

I

I

K

E

S

S

N

H

F

-

I

-

N

-

G

-

L

-

R
|
R

V

V

T

T

D

D

E

A

A

A

T

T

L

M

E

D

V

V

E

E

M

M

V

V

L

L

V

G

G

G

K

Q

V

V

N

N

K

K

E

D

I

I

V

V

G

N

L

L

I

I

E

N

K

R

A

H

G

G

K

S

A

A

V

I

G

G

L

L

S

T

G

G

K

K

D

D

A

A

G

E

L

L

I

I

K

R

A

A

H

-

K

K

L

L

A

T

K

-

N

-

P

-

E

-

P

-

T

-

G

-

E

-

Y

-

L

-

D

-

L

-

G

-

Y

-

V

V

G

G

E

E

I

V

S

T

E

G

V

V

N

N

P

V

E

G

I

L

L

L

L

N

T

M

L

L

I

V

D

K

K

G

G

D

Y

F

I

I

P

P

V

V

V

I

A

A

P

P

V

I

G

G

S

V

N

G

G

S

S

N

G

G

E

E

F

S

Y

Y

N
|
N

I

I

N
|
N

A
|
A

D
|
D

E

L

V

V

A

A

A

G

E

K

V

V

A

A

V

E

A

A

L

L

K

K

A

A

D

E

K

K

L

L

I

M

V

L

L

L

T

T

D

N

T

I

P

A

G

G

I

L

L

M

L

-

N

-

E

-

K

D

D

K

E

Q

N

G

S

Q

L

V

L

L

S

T

K

G

A

L

S

S

I

T

A

E

E

Q

V

V

K

N

E

E

L

L

I

I

N

A

R

D

G

G

V

T

I

I

R

Y

G

G

M

M

I

L

P

P

K
|
K

A

I

E

R

S

C

A

A

I

L

S

E

A

A

I

V

K

Q

R

G

G

G

V

V

G

T

S

S

V

A

H

H

I

I

D

D

G

G

R

R

I

V

A

P

H

N

S

A

L

V

L

L

E

E

I

I

F

F

T

T

D

D

A

S

G

G

V

V

G

G

T

T

M

L

L

I

T

S

active site: K32 (= K29), G35 (= G32), G68 (= G65), D175 (= D193), K231 (= K252)
binding n-acetyl-l-glutamate: R84 (= R86), N171 (= N189), N173 (= N191), A174 (= A192)

7nlyA Crystal structure of mycobacterium tuberculosis argb in complex with 2-chlorobenzimidazole.
44% identity, 97% coverage: 7:290/294 of query aligns to 11:288/293 of 7nlyA

query
sites
7nlyA

K

K

T

A

K

Q

V

V

L

L

I

A

E

E

A

A

L

L

P

P

Y

W

I

L

K

K

K

Q

F

L

Y

H

G

G

K

K

T

V

I

V

V

V

I

V

K

K

Y

Y

G

G

H

N

A

A

M

M

V

T

S

D

D

D

Q

T

L

L

K

R

E

R

A

A

V

F

I

A

N

A

D

D

L

M

V

A

L

F

M

L

K

R

F

N

V

C

G

G

I

I

N

H

P

P

V

V

H

H

G

G

P

P

E

Q

I

I

S

T

R

A

M

M

L

L

N

R

K

R

L

L

N

G

I

I

K

E

S

G

N

D

F

F

I

K

N

G

G

G

L

F

R

R

V

V

T

T

D

T

E

P

A

E

T

V

L

L

E

D

V

V

V

A

E

R

M

M

V

V

L

L

V

F

G

G

K

Q

V

V

N

G

K

R

E

E

I

L

V

V

G

N

L

L

I

I

E

N

K

A

A

H

G

G

G

P

K

Y

A

A

V
|
V

G

G

L

I

S

T

G

G

K

E

D

D

A

A

G

Q

L

L

I

F

K

T

A

A

H

V

K

R

L

S

A

V

K

T

N

-

P

-

E

-

P

-

T

V

G

D

E

G

E

V

Y

A

L

T

D

D

L

I

G

G

Y

L

V

V

G

G

E

D

I

V

S

D

E

Q

V

V

N

N

P

T

E

A

I

A

L

M

L

L

T

D

L
|
L

I

V

D

A

K

A

G

G

Y

R

I

I

P

P

V

V

A

S

P

T

V

L

G

A

S

P

N

D

G

A

S

D

G

G

E

V

F

V

Y

H

N

N

I

I

N

N

A

A

D

D

E

T

V

A

A

A

E

A

V

V

A

A

V

E

A

A

L

L

K

G

A

A

D

E

K

K

L

L

I

L

V

M

L

L

T

T

D

D

T

I

P

D

G

G

I

L

L

Y

L

T

N

R

E

W

K

P

D

D

E

R

N

D

S

S

L

L

L

V

S

S

K

E

A

I

S

D

I

T

A

G

E

T

V

L

K

A

E

Q

L

L

I

L

N

P

R

-

G

-

V

T

I

L

R

E

G

S

G

G

M

M

I

V

P

P

K

K

A

V

E

E

S

A

A

C

I

L

S

R

A

A

I

V

K

I

R

G

G

G

V

V

G

P

S

S

V

A

H

H

I

I

D

D

G

G

R

R

I

V

A

T

H

H

S

C

L

V

L

L

L

V

E

E

I

L

F

F

T

T

D

D

A

A

G

G

V

T

G

G

T

T

binding 2-chloranyl-1~{H}-benzimidazole: V124 (= V120), L167 (= L167)

7nnbA Crystal structure of mycobacterium tuberculosis argb in complex with 2,8-bis(trifluoromethyl)quinolin-4-ol.
44% identity, 97% coverage: 7:290/294 of query aligns to 9:286/291 of 7nnbA

query
sites
7nnbA

K

K

T

A

K

Q

V

V

L

L

I

A

E

E

A

A

L

L

P

P

Y

W

I

L

K

K

K

Q

F

L

Y

H

G

G

K

K

T

V

I

V

V

V

I

V

K

K

Y

Y

G

G

H

N

A

A

M

M

V

T

S

D

D

D

Q

T

L

L

K

R

E

R

A

A

V

F

I

A

N

A

D

D

L

M

V

A

L

F

M

L

K

R

F

N

V

C

G

G

I

I

N

H

P

P

V

V

H

H

G

G

P

P

E

Q

I

I

S

T

R

A

M

M

L

L

N

R

K

R

L

L

N

G

I

I

K

E

S

G

N

D

F

F

I

K

N

G

G

G

L

F

R

R

V

V

T

T

D

T

E

P

A

E

T

V

L

L

E

D

V

V

V

A

E

R

M

M

V

V

L

L

V

F

G

G

K

Q

V

V

N

G

K

R

E

E

I

L

V

V

G

N

L

L

I

I

E

N

K

A

A

H

G

G

G

P

K

Y

A

A

V
|
V

G

G

L

I

S

T

G

G

K

E

D

D

A

A

G

Q

L

L

I

F

K

T

A

A

H

V

K

R

L

S

A

V

K

T

N

-

P

-

E

-

P

-

T

V

G

D

E

G

E

V

Y

A

L

T

D

D

L

I

G

G

Y

L

V

V

G

G

E

D

I

V

S

D

E

Q

V

V

N

N

P

T

E

A

I

A

L

M

L

L

T

D

L
|
L

I

V

D

A

K

A

G

G

Y

R

I

I

P

P

V

V

A

S

P

T

V

L

G

A

S

P

N

D

G

A

S

D

G

G

E

V

F

V

Y

H

N

N

I

I

N

N

A

A

D

D

E

T

V

A

A

A

E

A

V

V

A

A

V

E

A

A

L

L

K

G

A

A

D

E

K

K

L

L

I

L

V

M

L

L

T

T

D

D

T

I

P

D

G

G

I

L

L

Y

L

T

N

R

E

W

K

P

D

D

E

R

N

D

S

S

L

L

L

V

S

S

K

E

A

I

S

D

I

T

A

G

E

T

V

L

K

A

E

Q

L

L

I

L

N

P

R

-

G

-

V

T

I

L

R

E

G

S

G

G

M

M

I

V

P

P

K

K

A

V

E

E

S

A

A

C

I

L

S

R

A

A

I

V

K

I

R

G

G

G

V

V

G

P

S

S

V

A

H

H

I

I

D

D

G

G

R

R

I

V

A

T

H

H

S

C

L

V

L

L

L

V

E

E

I

L

F

F

T

T

D

D

A

A

G

G

V

T

G

G

T

T

binding 2,8-bis(trifluoromethyl)quinolin-4-ol: V122 (= V120), L165 (= L167)

7nn8A Crystal structure of mycobacterium tuberculosis argb in complex with 1h-indole-3-carbonitrile.
44% identity, 97% coverage: 7:290/294 of query aligns to 9:286/291 of 7nn8A

query
sites
7nn8A

K

K

T

A

K

Q

V

V

L

L

I

A

E

E

A

A

L

L

P

P

Y

W

I

L

K

K

K

Q

F

L

Y

H

G

G

K

K

T

V

I

V

V

V

I

V

K

K

Y

Y

G

G

H

N

A

A

M

M

V

T

S

D

D

D

Q

T

L

L

K

R

E

R

A

A

V

F

I

A

N

A

D

D

L

M

V

A

L

F

M

L

K

R

F

N

V

C

G

G

I

I

N

H

P

P

V

V

H

H

G

G

P

P

E

Q

I

I

S

T

R

A

M

M

L

L

N

R

K

R

L

L

N

G

I

I

K

E

S

G

N

D

F

F

I

K

N

G

G

G

L

F

R

R

V

V

T

T

D

T

E

P

A

E

T

V

L

L

E

D

V

V

V

A

E

R

M

M

V

V

L

L

V

F

G

G

K

Q

V

V

N

G

K

R

E

E

I

L

V

V

G

N

L

L

I

I

E

N

K

A

A

H

G

G

G

P

K

Y

A

A

V
|
V

G

G

L

I

S

T

G

G

K

E

D

D

A

A

G

Q

L

L

I

F

K

T

A

A

H

V

K

R

L

S

A

V

K

T

N

-

P

-

E

-

P

-

T

V

G

D

E

G

E

V

Y

A

L

T

D

D

L

I

G

G

Y

L

V

V

G

G

E

D

I

V

S

D

E

Q

V

V

N

N

P

T

E

A

I

A

L

M

L

L

T

D

L
|
L

I

V

D

A

K

A

G

G

Y

R

I

I

P

P

V

V

A

S

P

T

V

L

G

A

S

P

N

D

G

A

S

D

G

G

E

V

F

V

Y

H

N

N

I

I

N

N

A

A

D

D

E

T

V

A

A

A

E

A

V

V

A

A

V

E

A

A

L

L

K

G

A

A

D

E

K

K

L

L

I

L

V

M

L

L

T

T

D

D

T

I

P

D

G

G

I

L

L

Y

L

T

N

R

E

W

K

P

D

D

E

R

N

D

S

S

L

L

L

V

S

S

K

E

A

I

S

D

I

T

A

G

E

T

V

L

K

A

E

Q

L

L

I

L

N

P

R

-

G

-

V

T

I

L

R

E

G

S

G

G

M

M

I

V

P

P

K

K

A

V

E

E

S

A

A

C

I

L

S

R

A

A

I

V

K

I

R

G

G

G

V

V

G

P

S

S

V

A

H

H

I

I

D

D

G

G

R

R

I

V

A

T

H

H

S

C

L

V

L

L

L

V

E

E

I

L

F

F

T

T

D

D

A

A

G

G

V

T

G

G

T

T

binding 1~{H}-indole-3-carbonitrile: V122 (= V120), L165 (= L167)

7nm0A Crystal structure of mycobacterium tuberculosis argb in complex with 1-(2,6-dihydroxyphenyl)ethan-1-one.
44% identity, 97% coverage: 7:290/294 of query aligns to 9:286/291 of 7nm0A

query
sites
7nm0A

K

K

T

A

K

Q

V

V

L

L

I

A

E

E

A

A

L

L

P

P

Y

W

I

L

K

K

K

Q

F

L

Y

H

G

G

K

K

T

V

I

V

V

V

I

V

K

K

Y

Y

G

G

H

N

A

A

M

M

V

T

S

D

D

D

Q

T

L

L

K

R

E

R

A

A

V

F

I

A

N

A

D

D

L

M

V

A

L

F

M

L

K

R

F

N

V

C

G

G

I

I

N

H

P

P

V

V

H

H

G

G

P

P

E

Q

I

I

S

T

R

A

M

M

L

L

N

R

K

R

L

L

N

G

I

I

K

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G

N

D

F

F

I

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N

G

G

G

L

F

R

R

V

V

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T

D

T

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P

A

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V

L

L

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D

V

V

V

A

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M

M

V

V

L

L

V

F

G

G

K

Q

V

V

N

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I

L

V

V

G

N

L

L

I

I

E

N

K

A

A

H

G

G

G

P

K

Y

A

A

V
|
V

G

G

L

I

S

T

G

G

K

E

D

D

A

A

G

Q

L

L

I

F

K

T

A

A

H

V

K

R

L

S

A

V

K

T

N

-

P

-

E

-

P

-

T

V

G

D

E

G

E

V

Y

A

L

T

D

D

L

I

G

G

Y

L

V

V

G

G

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D

I

V

S

D

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Q

V

V

N

N

P

T

E

A

I

A

L

M

L

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D

L
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L

I

V

D

A

K

A

G

G

Y

R

I

I

P

P

V

V

A

S

P

T

V

L

G

A

S

P

N

D

G

A

S

D

G

G

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F

V

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H

N

N

I

I

N

N

A

A

D

D

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T

V

A

A

A

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A

V

V

A

A

V

E

A

A

L

L

K

G

A

A

D

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K

K

L

L

I

L

V

M

L

L

T

T

D

D

T

I

P

D

G

G

I

L

L

Y

L

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N

R

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W

K

P

D

D

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N

D

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S

L

L

L

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S

S

K

E

A

I

S

D

I

T

A

G

E

T

V

L

K

A

E

Q

L

L

I

L

N

P

R

-

G

-

V

T

I

L

R

E

G

S

G

G

M

M

I

V

P

P

K

K

A

V

E

E

S

A

A

C

I

L

S

R

A

A

I

V

K

I

R

G

G

G

V

V

G

P

S

S

V

A

H

H

I

I

D

D

G

G

R

R

I

V

A

T

H

H

S

C

L

V

L

L

L

V

E

E

I

L

F

F

T

T

D

D

A

A

G

G

V

T

G

G

T

T

binding 1-[2,6-bis(oxidanyl)phenyl]ethanone: V122 (= V120), L165 (= L167)

7nlzA Crystal structure of mycobacterium tuberculosis argb in complex with 5-methoxy-6-(trifluoromethyl)indole.
44% identity, 97% coverage: 7:290/294 of query aligns to 9:286/291 of 7nlzA

query
sites
7nlzA

K

K

T

A

K

Q

V

V

L

L

I

A

E

E

A

A

L

L

P

P

Y

W

I

L

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K

K

Q

F

L

Y

H

G

G

K

K

T

V

I

V

V

V

I

V

K

K

Y

Y

G

G

H

N

A

A

M

M

V

T

S

D

D

D

Q

T

L

L

K

R

E

R

A

A

V

F

I

A

N

A

D

D

L

M

V

A

L

F

M

L

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F

N

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C

G

G

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I

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V

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H

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M

L

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K

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I

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F

F

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N

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G

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V

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L

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V

V

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V

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G

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V

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V

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N

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L

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I

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N

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A

A

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G

G

G

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K

Y

A

A

V
|
V

G

G

L

I

S

T

G

G

K

E

D

D

A

A

G

Q

L

L

I

F

K

T

A

A

H

V

K

R

L

S

A

V

K

T

N

-

P

-

E

-

P

-

T

V

G

D

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G

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V

Y

A

L

T

D

D

L

I

G

G

Y

L

V

V

G

G

E

D

I

V

S

D

E

Q

V

V

N

N

P

T

E

A

I

A

L

M

L

L

T

D

L
|
L

I

V

D

A

K

A

G

G

Y

R

I

I

P

P

V

V

A

S

P

T

V

L

G

A

S

P

N

D

G

A

S

D

G

G

E

V

F

V

Y

H

N

N

I

I

N

N

A

A

D

D

E

T

V

A

A

A

E

A

V

V

A

A

V

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A

A

L

L

K

G

A

A

D

E

K

K

L

L

I

L

V

M

L

L

T

T

D

D

T

I

P

D

G

G

I

L

L

Y

L

T

N

R

E

W

K

P

D

D

E

R

N

D

S

S

L

L

L

V

S

S

K

E

A

I

S

D

I

T

A

G

E

T

V

L

K

A

E

Q

L

L

I

L

N

P

R

-

G

-

V

T

I

L

R

E

G

S

G

G

M

M

I

V

P

P

K

K

A

V

E

E

S

A

A

C

I

L

S

R

A

A

I

V

K

I

R

G

G

G

V

V

G

P

S

S

V

A

H

H

I

I

D

D

G

G

R

R

I

V

A

T

H

H

S

C

L

V

L

L

L

V

E

E

I

L

F

F

T

T

D

D

A

A

G

G

V

T

G

G

T

T

binding 5-methoxy-6-(trifluoromethyl)-1~{H}-indole: V122 (= V120), L165 (= L167)

7nltA Crystal structure of mycobacterium tuberculosis argb in complex with 4-(4-methylpiperazin-1-yl)benzoic acid
44% identity, 97% coverage: 7:290/294 of query aligns to 9:286/291 of 7nltA

query
sites
7nltA

K

K

T

A

K

Q

V

V

L

L

I

A

E

E

A

A

L

L

P

P

Y

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L

Y

H

G

G

K

K

T

V

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V

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V

I

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K

Y

Y

G

G

H

N

A

A

M

M

V

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S

D

D

D

Q

T

L

L

K

R

E

R

A

A

V

F

I

A

N

A

D

D

L

M

V

A

L

F

M

L

K

R

F

N

V

C

G

G

I

I

N

H

P

P

V

V

H

H

G

G

P

P

E

Q

I

I

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T

R

A

M

M

L

L

N

R

K

R

L

L

N

G

I

I

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G

N

D

F

F

I

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N

G

G

G

L

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R

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V

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A

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V

A

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M

M

V

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L

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G

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Q

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V

N

G

K

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I

L

V

V

G

N

L

L

I

I

E

N

K

A

A

H

G

G

G

P

K

Y

A

A

V
|
V

G

G

L

I

S

T

G

G

K

E

D

D

A

A

G

Q

L
|
L

I

F

K

T

A

A

H

V

K

R

L

S

A

V

K

T

N

-

P

-

E

-

P

-

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G

D

E

G

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V

Y

A

L

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D

D

L

I

G

G

Y

L

V

V

G

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I

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S

D

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V

V

N

N

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A

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A

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M

L

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D

L
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L

I

V

D

A

K

A

G

G

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I

I

P

P

V

V

A

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T

V

L

G

A

S

P

N

D

G

A

S

D

G

G

E

V

F

V

Y

H

N

N

I

I

N

N

A

A

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D

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V

A

A

A

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A

V

V

A

A

V

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A

A

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L

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A

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K

K

L

L

I

L

V

M

L

L

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D

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D

G

G

I

L

L

Y

L

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N

R

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W

K

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D

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N

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S