SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing 7025069 FitnessBrowser__ANA3:7025069 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)

P0AC81 Lactoylglutathione lyase; Aldoketomutase; Glyoxalase I; Glx I; Ketone-aldehyde mutase; Methylglyoxalase; S-D-lactoylglutathione methylglyoxal lyase; EC 4.4.1.5 from Escherichia coli (strain K12) (see paper)
72% identity, 99% coverage: 3:136/136 of query aligns to 2:134/135 of P0AC81

query
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P0AC81

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H5 (= H6) binding
E56 (= E58) binding
H74 (= H76) binding in other chain
E122 (= E124) binding in other chain

1fa6A Crystal structure of the co(ii)-bound glyoxalase i of escherichia coli (see paper)
73% identity, 92% coverage: 3:127/136 of query aligns to 2:125/128 of 1fa6A

query
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1fa6A

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active site: H5 (= H6), E56 (= E58), H74 (= H76), E122 (= E124)
binding cobalt (ii) ion: H5 (= H6), E56 (= E58), H74 (= H76), E122 (= E124)

1fa5A Crystal structure of the zn(ii)-bound glyoxalase i of escherichia coli (see paper)
73% identity, 92% coverage: 3:127/136 of query aligns to 2:125/128 of 1fa5A

query
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1fa5A

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active site: H5 (= H6), E56 (= E58), H74 (= H76), E122 (= E124)
binding zinc ion: H5 (= H6), E56 (= E58), H74 (= H76), E122 (= E124)

5d7zA Crystal structure of glyoxalase i from zea mays (see paper)
54% identity, 99% coverage: 2:135/136 of query aligns to 9:141/281 of 5d7zA

query
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5d7zA

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active site: H13 (= H6), E64 (= E58), H82 (= H76), E130 (= E124)

Sites not aligning to the query:

binding nickel (ii) ion: 276, 281

6bnnA Crystal structure of v278e-glyoxalase i mutant from zea mays in space group p4(1)2(1)2 (see paper)
54% identity, 99% coverage: 2:135/136 of query aligns to 15:147/282 of 6bnnA

query
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6bnnA

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active site: H19 (= H6), E70 (= E58), H88 (= H76), E136 (= E124)
binding cobalt (ii) ion: H88 (= H76), E136 (= E124)
binding glutathione: R112 (= R100), V117 (= V105), K118 (≠ A106)

Sites not aligning to the query:

Q948T6 Lactoylglutathione lyase; Aldoketomutase; Allergen Glb33; Glyoxalase I; Glx I; Glyoxylase I 11; OsGLYI-11; OsGLYI11; Ketone-aldehyde mutase; Methylglyoxalase; PP33; S-D-lactoylglutathione methylglyoxal lyase; Allergen Ory s Glyoxalase I; EC 4.4.1.5 from Oryza sativa subsp. japonica (Rice) (see paper)
55% identity, 93% coverage: 2:127/136 of query aligns to 23:148/291 of Q948T6

query
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Q948T6

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E78 (= E58) mutation to Q: No effect on the activity.
E145 (= E124) mutation to Q: Loss of activity.

Sites not aligning to the query:

209 E→D: Loss of activity.

4mttA Ni- and zn-bound gloa2 at low resolution (see paper)
47% identity, 92% coverage: 3:127/136 of query aligns to 2:125/128 of 4mttA

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4mttA

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active site: H5 (= H6), E56 (= E58), H74 (= H76), E122 (= E124)
binding zinc ion: H5 (= H6), E56 (= E58)

2c21A Specificity of the trypanothione-dependednt leishmania major glyoxalase i: structure and biochemical comparison with the human enzyme (see paper)
45% identity, 96% coverage: 3:133/136 of query aligns to 3:127/139 of 2c21A

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2c21A

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active site: H6 (= H6), E57 (= E58), H75 (= H76), E118 (= E124)
binding nickel (ii) ion: H6 (= H6), E57 (= E58), H75 (= H76), E118 (= E124)

P50107 Glyoxalase I; Glx I; Aldoketomutase; Ketone-aldehyde mutase; Methylglyoxalase; S-D-lactoylglutathione methylglyoxal lyase; actoylglutathione lyase; EC 4.4.1.5 from Saccharomyces cerevisiae (strain ATCC 204508 / S288c) (Baker's yeast) (see paper)
42% identity, 92% coverage: 2:126/136 of query aligns to 181:320/326 of P50107

query
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P50107

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A

E

I

I

A

E

A

V

A

K

-

Y

G

G

G

D

K

K

V

I

T

Q

R

W

A

S

P

P

G

K

P

F

V

N

A

Q

G

G

G

R

T

M

T

K

E

N

I

I

A

A

F

F

V

L

E

K

D

D

P

P

D

D

G

G

Y

Y

K

S

I

I

E
|
E

F

V

I

V

E318 (= E124) active site, Proton donor/acceptor

Sites not aligning to the query:

163 active site, Proton donor/acceptor

Q04760 Lactoylglutathione lyase; Aldoketomutase; Glyoxalase I; Glx I; Ketone-aldehyde mutase; Methylglyoxalase; S-D-lactoylglutathione methylglyoxal lyase; EC 4.4.1.5 from Homo sapiens (Human) (see 12 papers)
35% identity, 91% coverage: 4:127/136 of query aligns to 32:176/184 of Q04760

query
sites
Q04760

L

L

L

Q

H
x
Q

T

T

M

M

L

L

R

R

V

V

G

K

N

D

L

P

E

K

R

K

S
|
S

I

L

A

D

F

F

Y

Y

T

T

Q

R

V

V

L

L

G

G

M

M

K

T

L

L

L

I

R

Q

T

K

S
x
C

E

D

N

F

P

P

E

I

Y

M

K

K

Y

F

S
|
S

L

L

A

Y

F

F

V

L

G

A

F

Y

G

E

E

D

E

K

S

N

-

D

-

I

-

P

-

K

-

E

-

K

-

D

-

E

-

K

-

I

-

A

-

W

-

A

-

L

T
x
S

G

R

Q

K

A

A

V
x
T

I

L

E
|
E

L

L

T
|
T

Y

H

N

N

W

W

G

G

T
|
T

E

E

K

D

-

D

-
x
E

-

T

-

Q

-

S

Y

Y

D

H

L

N

G

G

T

N

A

S

-

D

-

P

-

R

-

G

F

F

G

G

H
|
H

I

I

A

G

I

I

G

A

D

V

E

P

D

D

I

V

Y

Y

A

S

R

A

C
|
C

E

K

A

R

I

F

A

E

A

L

G

G

G

V

K

K

V

F

T

V

R

K

A

K

P

P

G

D

P

-

V

-

A

D

G

G

G

K

T

M

T

K

E

G

I

L

A

A

F

F

V

I

E

Q

D

D

P

P

D

D

G

G

Y

Y

K

W

I

I

E
|
E

F

I

I

L

Q

N

Q34 (≠ H6) binding ; mutation to E: Reduces enzyme activity by 99%.
S45 (= S17) mutation to A: No effect on phosphorylation.
C61 (≠ S33) modified: Disulfide link with 139, Alternate; mutation to A: No effect on NO-mediated modification.
S69 (= S41) mutation to A: No effect on phosphorylation.
S94 (≠ T52) mutation to A: No effect on phosphorylation.
T98 (≠ V56) mutation to A: No effect on phosphorylation.
E100 (= E58) binding ; mutation to Q: Reduces enzyme activity by over 99%.
T102 (= T60) mutation to A: No effect on phosphorylation.
T107 (= T65) modified: Phosphothreonine; mutation to A: Loss of phosphorylation.
E111 (vs. gap) to A: in dbSNP:rs4746
H127 (= H76) binding in other chain
C139 (= C88) modified: S-glutathionyl cysteine; alternate; modified: Disulfide link with 61, Alternate; mutation to A: Impaired NO-mediated modification. Loss of NO-mediated modification; when associated with A-19 or A-20.
E173 (= E124) active site, Proton donor/acceptor; binding in other chain; mutation to Q: Abolishes enzyme activity.

Sites not aligning to the query:

1 modified: Initiator methionine, Removed
2 modified: N-acetylalanine
19 modified: Disulfide link with 20; C → Y: in dbSNP:rs17855424; C→A: No effect on NO-mediated modification. Impaired NO-mediated modification; when associated with A-20. Loss of NO-mediated modification; when associated with A-139.
20 modified: Disulfide link with 19; C→A: No effect on NO-mediated modification. Impaired NO-mediated modification; when associated with A-19. Loss of NO-mediated modification; when associated with A-139.

7wt0A Human glyoxalase i (with c-ter his tag) in complex with tlsc702 (see paper)
35% identity, 91% coverage: 4:127/136 of query aligns to 31:175/185 of 7wt0A

query
sites
7wt0A

L

L

L

Q

H
x
Q

T

T

M

M

L

L

R

R

V

V

G

K

N

D

L

P

E

K

R

K

S

S

I

L

A

D

F

F

Y

Y

T

T

Q

R

V

V

L

L

G

G

M

M

K

T

L

L

L

I

R

Q

T

K

S
x
C

E

D

N
x
F

P

P

E

I

Y

M

K

K

Y

F

S

S

L
|
L

A

Y

F
|
F

V

L

G

A

F

Y

G

E

E

D

E

K

S

N

-

D

-

I

-

P

-

K

-

E

-

K

-

D

-

E

-

K

-

I

-

A

-

W

-

A

-
x
L

T

S

G

R

Q

K

A

A

V

T

I

L

E
|
E

L

L

T

T

Y

H

N

N

W

W

G

G

T

T

E

E

K

D

-

D

-

E

-

T

-

Q

-

S

Y

Y

D

H

L

N

G

G

T

N

A

S

-

D

-

P

-

R

-

G

F

F

G

G

H
|
H

I

I

A

G

I

I

G

A

D

V

E

P

D

D

I

V

Y

Y

A

S

R

A

C

C

E

K

A

R

I

F

A

E

A

L

G

G

G

V

K

K

V

F

T

V

R
x
K

A

K

P

P

G

D

P

-

V

-

A

D

G

G

G

K

T
x
M

T

K

E

G

I
x
L

A

A

F
|
F

V

I

E

Q

D

D

P

P

D

D

G

G

Y

Y

K

W

I

I

E
|
E

F

I

I

L

Q

N

binding (~{E})-3-(1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)but-3-enoic acid: C60 (≠ S33), F62 (≠ N35), L69 (= L42), F71 (= F44), L92 (vs. gap), E99 (= E58), H126 (= H76), K150 (≠ R100), M157 (≠ T109), L160 (≠ I112), F162 (= F114), E172 (= E124)
binding zinc ion: Q33 (≠ H6), E99 (= E58), H126 (= H76), E172 (= E124)

Sites not aligning to the query:

binding (~{E})-3-(1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)but-3-enoic acid: 179, 183

7wszA Human glyoxalase i (with c-ter his tag) in glycerol-bound form (see paper)
35% identity, 91% coverage: 4:127/136 of query aligns to 24:168/183 of 7wszA

query
sites
7wszA

L

L

L

Q

H
x
Q

T

T

M

M

L

L

R

R

V

V

G

K

N

D

L

P

E

K

R

K

S

S

I

L

A

D

F

F

Y

Y

T

T

Q

R

V

V

L

L

G

G

M

M

K

T

L

L

L
x
I

R
x
Q

T
x
K

S

C

E

D

N

F

P

P

E

I

Y

M

K

K

Y

F

S

S

L

L

A

Y

F

F

V

L

G

A

F

Y

G

E

E

D

E

K

S

N

-

D

-

I

-

P

-

K

-

E

-

K

-

D

-

E

-
x
K

-

I

-

A

-

W

-

A

-

L

T

S

G

R

Q

K

A

A

V

T

I

L

E
|
E

L

L

T

T

Y

H

N

N

W

W

G

G

T

T

E

E

K

D

-

D

-

E

-

T

-

Q

-

S

Y

Y

D

H

L

N

G

G

T

N

A

S

-

D

-

P

-

R

-

G

F

F

G

G

H
|
H

I

I

A

G

I

I

G

A

D

V

E

P

D

D

I

V

Y

Y

A

S

R

A

C

C

E

K

A

R

I

F

A

E

A

L

G

G

G

V

K

K

V

F

T

V

R

K

A

K

P

P

G

D

P

-

V

-

A

D

G

G

G

K

T
x
M

T

K

E

G

I

L

A

A

F

F

V

I

E

Q

D

D

P

P

D

D

G

G

Y

Y

K

W

I

I

E
|
E

F

I

I

L

Q

N

binding glycerol: I50 (≠ L30), Q51 (≠ R31), K52 (≠ T32), K80 (vs. gap), H119 (= H76), M150 (≠ T109), E165 (= E124)
binding zinc ion: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)

Sites not aligning to the query:

binding glycerol: 176

3w0tA Human glyoxalase i with an n-hydroxypyridone derivative inhibitor
35% identity, 91% coverage: 4:127/136 of query aligns to 24:168/176 of 3w0tA

query
sites
3w0tA

L

L

L

Q

H
x
Q

T

T

M

M

L

L

R

R

V

V

G

K

N

D

L

P

E

K

R

K

S

S

I

L

A

D

F

F

Y

Y

T

T

Q

R

V

V

L

L

G

G

M

M

K

T

L

L

L

I

R

Q

T

K

S

C

E

D

N
x
F

P

P

E

I

Y

M

K

K

Y
x
F

S

S

L
|
L

A

Y

F
|
F

V

L

G

A

F

Y

G

E

E

D

E

K

S

N

-

D

-

I

-

P

-

K

-

E

-

K

-

D

-

E

-

K

-

I

-

A

-

W

-

A

-

L

T

S

G

R

Q

K

A

A

V

T

I

L

E
|
E

L

L

T

T

Y

H

N

N

W

W

G

G

T

T

E

E

K

D

-

D

-

E

-

T

-

Q

-

S

Y

Y

D

H

L

N

G

G

T

N

A

S

-

D

-

P

-

R

-

G

F

F

G

G

H
|
H

I

I

A

G

I

I

G

A

D

V

E

P

D

D

I

V

Y

Y

A

S

R

A

C

C

E

K

A

R

I

F

A

E

A

L

G

G

G

V

K

K

V

F

T

V

R

K

A

K

P

P

G

D

P

-

V

-

A

D

G

G

G

K

T

M

T

K

E

G

I

L

A

A

F

F

V

I

E

Q

D

D

P

P

D

D

G

G

Y

Y

K

W

I

I

E
|
E

F

I

I

L

Q

N

active site: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)
binding N-[3-(1-hydroxy-6-oxo-4-phenyl-1,6-dihydropyridin-2-yl)phenyl]methanesulfonamide: Q26 (≠ H6), F55 (≠ N35), F60 (≠ Y40), L62 (= L42), F64 (= F44), E92 (= E58), H119 (= H76), E165 (= E124)
binding zinc ion: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)

Sites not aligning to the query:

binding N-[3-(1-hydroxy-6-oxo-4-phenyl-1,6-dihydropyridin-2-yl)phenyl]methanesulfonamide: 172, 176

3vw9A Human glyoxalase i with an n-hydroxypyridone inhibitor (see paper)
35% identity, 91% coverage: 4:127/136 of query aligns to 24:168/176 of 3vw9A

query
sites
3vw9A

L

L

L

Q

H
x
Q

T

T

M

M

L

L

R

R

V

V

G

K

N

D

L

P

E

K

R

K

S

S

I

L

A

D

F

F

Y

Y

T

T

Q

R

V

V

L

L

G

G

M

M

K

T

L

L

L

I

R

Q

T

K

S
x
C

E

D

N

F

P

P

E

I

Y

M

K

K

Y

F

S

S

L
|
L

A

Y

F

F

V

L

G

A

F

Y

G

E

E

D

E

K

S

N

-

D

-

I

-

P

-

K

-

E

-

K

-

D

-

E

-

K

-

I

-

A

-

W

-

A

-

L

T

S

G

R

Q

K

A

A

V

T

I

L

E
|
E

L

L

T

T

Y

H

N

N

W

W

G

G

T

T

E

E

K

D

-

D

-

E

-

T

-

Q

-

S

Y

Y

D

H

L

N

G

G

T

N

A

S

-

D

-

P

-

R

-

G

F

F

G

G

H
|
H

I

I

A

G

I

I

G

A

D

V

E

P

D

D

I

V

Y

Y

A

S

R

A

C

C

E

K

A

R

I

F

A

E

A

L

G

G

G

V

K

K

V

F

T

V

R

K

A

K

P

P

G

D

P

-

V

-

A

D

G

G

G

K

T
x
M

T

K

E

G

I

L

A

A

F
|
F

V

I

E

Q

D

D

P

P

D

D

G

G

Y

Y

K

W

I

I

E
|
E

F

I

I

L

Q

N

active site: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)
binding 1-hydroxy-6-[1-(3-methoxypropyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-phenylpyridin-2(1H)-one: Q26 (≠ H6), C53 (≠ S33), L62 (= L42), E92 (= E58), H119 (= H76), M150 (≠ T109), F155 (= F114), E165 (= E124)
binding zinc ion: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)

Sites not aligning to the query:

binding 1-hydroxy-6-[1-(3-methoxypropyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-4-phenylpyridin-2(1H)-one: 172, 176

1qipA Human glyoxalase i complexed with s-p- nitrobenzyloxycarbonylglutathione (see paper)
35% identity, 91% coverage: 4:127/136 of query aligns to 24:168/176 of 1qipA

query
sites
1qipA

L

L

L

Q

H
x
Q

T

T

M

M

L

L

R
|
R

V

V

G

K

N

D

L

P

E

K

R

K

S

S

I

L

A

D

F

F

Y

Y

T

T

Q

R

V

V

L

L

G

G

M

M

K

T

L

L

L

I

R
x
Q

T

K

S
x
C

E

D

N

F

P

P

E

I

Y

M

K

K

Y
x
F

S

S

L

L

A

Y

F
|
F

V

L

G

A

F

Y

G

E

E

D

E

K

S

N

-

D

-

I

-

P

-

K

-

E

-

K

-

D

-

E

-

K

-
x
I

-

A

-

W

-

A

-
x
L

T

S

G

R

Q

K

A

A

V

T

I

L

E
|
E

L

L

T
|
T

Y

H

N
|
N

W

W

G

G

T

T

E

E

K

D

-

D

-

E

-

T

-

Q

-

S

Y

Y

D

H

L

N

G

G

T

N

A

S

-

D

-

P

-
x
R

-

G

F

F

G

G

H
|
H

I

I

A

G

I

I

G

A

D

V

E

P

D

D

I

V

Y

Y

A

S

R

A

C

C

E

K

A

R

I

F

A

E

A

L

G

G

G

V

K

K

V

F

T

V

R

K

A

K

P

P

G

D

P

-

V

-

A

D

G

G

G

K

T
x
M

T

K

E

G

I

L

A

A

F
|
F

V

I

E

Q

D

D

P

P

D

D

G

G

Y

Y

K

W

I

I

E
|
E

F

I

I

L

Q

N

active site: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)
binding s-p-nitrobenzyloxycarbonylglutathione: R30 (= R10), Q51 (≠ R31), C53 (≠ S33), F60 (≠ Y40), F64 (= F44), I81 (vs. gap), L85 (vs. gap), T94 (= T60), N96 (= N62), R115 (vs. gap), M150 (≠ T109), F155 (= F114)
binding zinc ion: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)

Sites not aligning to the query:

binding s-p-nitrobenzyloxycarbonylglutathione: 172

1qinA Human glyoxalase i complexed with s-(n-hydroxy-n-p- iodophenylcarbamoyl) glutathione (see paper)
35% identity, 91% coverage: 4:127/136 of query aligns to 24:168/176 of 1qinA

query
sites
1qinA

L

L

L

Q

H
x
Q

T

T

M

M

L

L

R
|
R

V

V

G

K

N

D

L

P

E

K

R

K

S

S

I

L

A

D

F

F

Y

Y

T

T

Q

R

V

V

L

L

G

G

M

M

K

T

L

L

L

I

R

Q

T

K

S

C

E

D

N

F

P

P

E

I

Y

M

K

K

Y
x
F

S

S

L
|
L

A

Y

F
|
F

V

L

G

A

F

Y

G

E

E

D

E

K

S

N

-

D

-

I

-

P

-

K

-

E

-

K

-

D

-

E

-

K

-

I

-

A

-

W

-

A

-

L

T

S

G

R

Q

K

A

A

V

T

I

L

E
|
E

L

L

T
|
T

Y

H

N
|
N

W

W

G

G

T

T

E

E

K

D

-

D

-

E

-

T

-

Q

-

S

Y

Y

D

H

L

N

G

G

T

N

A

S

-

D

-

P

-
x
R

-

G

F

F

G

G

H
|
H

I

I

A

G

I

I

G

A

D

V

E

P

D

D

I

V

Y

Y

A

S

R

A

C

C

E

K

A

R

I

F

A

E

A

L

G

G

G

V

K

K

V

F

T

V

R
x
K

A

K

P

P

G

D

P

-

V

-

A

D

G
|
G

G
x
K

T
x
M

T

K

E

G

I

L

A

A

F

F

V

I

E

Q

D

D

P

P

D

D

G

G

Y

Y

K

W

I

I

E
|
E

F

I

I

L

Q

N

active site: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)
binding s-(n-hydroxy-n-iodophenylcarbamoyl)glutathione: Q26 (≠ H6), R30 (= R10), F60 (≠ Y40), L62 (= L42), F64 (= F44), E92 (= E58), T94 (= T60), N96 (= N62), R115 (vs. gap), H119 (= H76), K143 (≠ R100), G148 (= G107), K149 (≠ G108), M150 (≠ T109), E165 (= E124)
binding zinc ion: Q26 (≠ H6), E92 (= E58)

Sites not aligning to the query:

binding s-(n-hydroxy-n-iodophenylcarbamoyl)glutathione: 172

1froA Human glyoxalase i with benzyl-glutathione inhibitor (see paper)
35% identity, 91% coverage: 4:127/136 of query aligns to 24:168/176 of 1froA

query
sites
1froA

L

L

L

Q

H
x
Q

T

T

M

M

L

L

R
|
R

V

V

G

K

N

D

L

P

E

K

R

K

S

S

I

L

A

D

F

F

Y

Y

T

T

Q

R

V

V

L

L

G

G

M

M

K

T

L

L

L

I

R

Q

T

K

S

C

E

D

N

F

P

P

E

I

Y

M

K

K

Y
x
F

S

S

L

L

A

Y

F

F

V

L

G

A

F

Y

G

E

E

D

E

K

S

N

-

D

-

I

-

P

-

K

-

E

-

K

-

D

-

E

-

K

-

I

-

A

-

W

-

A

-

L

T

S

G

R

Q

K

A

A

V

T

I

L

E
|
E

L

L

T
|
T

Y

H

N
|
N

W

W

G

G

T

T

E

E

K

D

-

D

-

E

-

T

-

Q

-

S

Y

Y

D

H

L

N

G

G

T

N

A

S

-

D

-

P

-
x
R

-

G

F

F

G

G

H
|
H

I

I

A

G

I

I

G

A

D

V

E

P

D

D

I

V

Y

Y

A

S

R

A

C

C

E

K

A

R

I

F

A

E

A

L

G

G

G

V

K

K

V

F

T

V

R

K

A

K

P

P

G

D

P

-

V

-

A

D

G

G

G

K

T
x
M

T

K

E

G

I

L

A

A

F
|
F

V

I

E

Q

D

D

P

P

D

D

G

G

Y

Y

K

W

I

I

E
|
E

F

I

I

L

Q

N

active site: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)
binding s-benzyl-glutathione: R30 (= R10), F60 (≠ Y40), T94 (= T60), N96 (= N62), R115 (vs. gap), M150 (≠ T109), F155 (= F114), E165 (= E124)
binding zinc ion: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)

Sites not aligning to the query:

binding s-benzyl-glutathione: 176

3w0uA Human glyoxalase i with an n-hydroxypyridone inhibitor
35% identity, 91% coverage: 4:127/136 of query aligns to 24:168/175 of 3w0uA

query
sites
3w0uA

L

L

L

Q

H
x
Q

T

T

M

M

L

L

R

R

V

V

G

K

N

D

L

P

E

K

R

K

S

S

I

L

A

D

F

F

Y

Y

T

T

Q

R

V

V

L

L

G

G

M

M

K

T

L

L

L

I

R

Q

T

K

S

C

E

D

N

F

P

P

E

I

Y

M

K

K

Y
x
F

S

S

L
|
L

A

Y

F

F

V

L

G

A

F

Y

G

E

E

D

E

K

S

N

-

D

-

I

-

P

-

K

-

E

-

K

-

D

-

E

-

K

-

I

-

A

-

W

-

A

-

L

T

S

G

R

Q

K

A

A

V

T

I

L

E
|
E

L

L

T

T

Y

H

N

N

W

W

G

G

T

T

E

E

K

D

-

D

-

E

-

T

-

Q

-

S

Y

Y

D

H

L

N

G

G

T

N

A

S

-

D

-

P

-

R

-

G

F

F

G

G

H
|
H

I

I

A

G

I

I

G

A

D

V

E

P

D

D

I

V

Y

Y

A

S

R

A

C

C

E

K

A

R

I

F

A

E

A

L

G

G

G

V

K

K

V

F

T

V

R
x
K

A

K

P

P

G

D

P

-

V

-

A

D

G

G

G

K

T
x
M

T

K

E

G

I

L

A

A

F

F

V

I

E

Q

D

D

P

P

D

D

G

G

Y

Y

K

W

I

I

E
|
E

F

I

I

L

Q

N

active site: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)
binding N-[3-(1-Hydroxy-6-oxo-4-phenyl-1,6-dihydro-pyridin-2-yl)-5-methanesulfonylamino-phenyl]-methanesulfonamide: Q26 (≠ H6), F60 (≠ Y40), L62 (= L42), E92 (= E58), H119 (= H76), K143 (≠ R100), M150 (≠ T109), E165 (= E124)
binding zinc ion: Q26 (≠ H6), E92 (= E58), H119 (= H76), E165 (= E124)

Sites not aligning to the query:

binding N-[3-(1-Hydroxy-6-oxo-4-phenyl-1,6-dihydro-pyridin-2-yl)-5-methanesulfonylamino-phenyl]-methanesulfonamide: 172

Q9CPU0 Lactoylglutathione lyase; Aldoketomutase; Glyoxalase I; Glx I; Ketone-aldehyde mutase; Methylglyoxalase; S-D-lactoylglutathione methylglyoxal lyase; EC 4.4.1.5 from Mus musculus (Mouse) (see paper)
35% identity, 91% coverage: 4:127/136 of query aligns to 32:176/184 of Q9CPU0

query
sites
Q9CPU0

L

L

L

Q

H
x
Q

T

T

M

M

L

L

R

R

V

I

G

K

N

D

L

P

E

K

R

K

S

S

I

L

A

D

F

F

Y

Y

T

T

Q

R

V

V

L

L

G

G

M

L

K

T

L

L

R

Q

T

K

S

L

E

D

N

F

P

P

E

A

Y

M

K

K

Y

F

S

S

L

L

A

Y

F

F

V

L

G

A

F

Y

G

E

E

D

E

K

S

N

-

D

-

I

-

P

-

K

-

D

-

K

-

S

-

E

-

K

-

T

-

A

-

W

-

T

-

F

T

S

G

R

Q

K

A

A

V

T

I

L

E
|
E

L

L

T

T

Y

H

N

N

W

W

G

G

T

T

E

E

K

D

-

D

-

E

-

T

-

Q

-

S

Y

Y

D

H

L

N

G

G

T

N

A

S

-

D

-

P

-

R

-

G

F

F

G

G

H
|
H

I

I

A

G

I

I

G

A

D

V

E

P

D

D

I

V

Y

Y

A

S

R

A

C

C

E

K

A

R

I

F

A

E

A

L

G

G

G

V

K

K

V

F

T

V

R

K

A

K

P

P

G

D

P

-

V

-

A

D

G

G

G

K

T

M

T

K

E

G

I

L

A

A

F

F

V

I

E

Q

D

D

P

P

D

D

G

G

Y

Y

K

W

I

I

E
|
E

F

I

I

L

Q

N

Q34 (≠ H6) binding
E100 (= E58) binding
H127 (= H76) binding in other chain
E173 (= E124) binding in other chain

4x2aA Crystal structure of mouse glyoxalase i complexed with baicalein (see paper)
35% identity, 91% coverage: 4:127/136 of query aligns to 18:162/167 of 4x2aA

query
sites
4x2aA

L

L

L

Q

H
x
Q

T

T

M

M

L

L

R

R

V

I

G

K

N

D

L

P

E

K

R

K

S

S

I

L

A

D

F

F

Y

Y

T

T

Q

R

V

V

L

L

G

G

M

L

K

T

L

L

R

Q

T

K

S

L

E

D

N
x
F

P

P

E

A

Y

M

K

K

Y

F

S

S

L
|
L

A

Y

F

F

V

L

G

A

F

Y

G

E

E

D

E

K

S

N

-

D

-

I

-

P

-

K

-

D

-

K

-

S

-

E

-

K

-

T

-

A

-

W

-

T

-
x
F

T

S

G

R

Q

K

A

A

V

T

I

L

E
|
E

L

L

T

T

Y

H

N

N

W

W

G

G

T

T

E

E

K

D

-

D

-

E

-

T

-

Q

-

S

Y

Y

D

H

L

N

G

G

T

N

A

S

-

D

-

P

-

R

-

G

F

F

G

G

H
|
H

I

I

A

G

I

I

G

A

D

V

E

P

D

D

I

V

Y

Y

A

S

R

A

C

C

E

K

A

R

I

F

A

E

A

L

G

G

G

V

K

K

V

F

T

V

R

K

A

K

P

P

G

D

P

-

V

-

A

D

G

G

G

K

T
x
M

T

K

E

G

I

L

A

A

F

F

V

I

E

Q

D

D

P

P

D

D

G

G

Y

Y

K

W

I

I

E
|
E

F

I

I

L

Q

N

active site: Q20 (≠ H6), E86 (= E58), H113 (= H76), E159 (= E124)
binding 5,6,7-trihydroxy-2-phenyl-4H-chromen-4-one: Q20 (≠ H6), F49 (≠ N35), L56 (= L42), F79 (vs. gap), E86 (= E58), H113 (= H76), M144 (≠ T109), E159 (= E124)
binding zinc ion: Q20 (≠ H6), E86 (= E58), H113 (= H76), E159 (= E124)

Sites not aligning to the query:

binding 5,6,7-trihydroxy-2-phenyl-4H-chromen-4-one: 166, 167

Query Sequence

>7025069 FitnessBrowser__ANA3:7025069
MSQLLHTMLRVGNLERSIAFYTQVLGMKLLRTSENPEYKYSLAFVGFGEESTGQAVIELT
YNWGTEKYDLGTAFGHIAIGDEDIYARCEAIAAAGGKVTRAPGPVAGGTTEIAFVEDPDG
YKIEFIQMKSATQGLG

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