SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing PfGW456L13_1417 FitnessBrowser__pseudo13_GW456_L13:PfGW456L13_1417 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)

A0QV10 Aldo-keto reductase MSMEG_2408/MSMEI_2347; EC 1.1.1.- from Mycolicibacterium smegmatis (strain ATCC 700084 / mc(2)155) (Mycobacterium smegmatis) (see paper)
38% identity, 94% coverage: 9:267/277 of query aligns to 10:267/275 of A0QV10

query
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A0QV10

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K262 (≠ E261) modified: Isoglutamyl lysine isopeptide (Lys-Gln) (interchain with Q-Cter in protein Pup)

Q9GV41 9,11-endoperoxide prostaglandin H2 reductase; Prostaglandin F2-alpha synthase; EC 1.1.1.- from Trypanosoma brucei brucei
35% identity, 94% coverage: 7:267/277 of query aligns to 10:268/276 of Q9GV41

query
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Q9GV41

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MW 22:23 (≠ TW 19:20) binding
D47 (= D43) binding
SN 139:140 (≠ AN 136:137) binding
Q161 (= Q158) binding
WSPLGQ 187:192 (≠ YTPLAR 184:189) binding
KSG 230:232 (≠ KAS 228:230) binding
RIKEN 236:240 (≠ NQLAN 234:238) binding

1vbjA The crystal structure of prostaglandin f synthase from trypanosoma brucei
35% identity, 94% coverage: 7:267/277 of query aligns to 15:273/281 of 1vbjA

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active site: D52 (= D43), Y57 (= Y48), K82 (= K73), H115 (= H106)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G26 (= G18), M27 (≠ T19), W28 (= W20), D52 (= D43), Y57 (= Y48), H115 (= H106), N145 (= N137), Q166 (= Q158), W192 (≠ Y184), S193 (≠ T185), P194 (= P186), L195 (= L187), Q197 (≠ R189), G198 (≠ N190), V201 (≠ S193), A218 (≠ T210), I233 (= I226), K235 (= K228), S236 (≠ A229), G237 (≠ S230), R241 (≠ N234), E244 (≠ A237), N245 (= N238)

6kiyA Crystal structure of a thermostable aldo-keto reductase tm1743 in complex with inhibitor epalrestat (see paper)
34% identity, 92% coverage: 5:258/277 of query aligns to 7:275/275 of 6kiyA

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binding {5-[(2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}acetic acid: W22 (= W20), Y59 (= Y48), W87 (= W75), H118 (= H106), R204 (= R189)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G20 (= G18), T21 (= T19), W22 (= W20), Y59 (= Y48), H118 (= H106), N149 (= N137), Q170 (= Q158), Y199 (= Y184), S200 (≠ T185), P201 (= P186), L202 (= L187), R204 (= R189), T205 (≠ N190), Y227 (≠ T210), I243 (= I226), P244 (= P227), K245 (= K228), G247 (≠ S230), R248 (≠ S231), H251 (≠ N234), E254 (≠ A237), N255 (= N238)

6kikA Crystal structure of a thermostable aldo-keto reductase tm1743 in complex with inhibitor tolrestat (see paper)
34% identity, 92% coverage: 5:258/277 of query aligns to 7:275/275 of 6kikA

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R

L

L

R

D

S

T

E

D

Y

Y

V

V

D

D

L

L

F

Y

M

L

L

I

H
|
H

W

W

P

P

T

N

T

P

D

E

W

I

D

P

L

L

P

E

R

E

T

T

I

L

E

S

T

A

L

M

V

A

S

E

F

G

R

V

E

R

Q

Q

G

G

L

L

A

I

R

R

N

Y

I

I

G

G

V

V

A

S

N

N

F

F

P

D

L

R

H

R

L

L

R

E

K

E

V

A

V

I

E

S

E

K

L

S

G

Q

A

E

P

P

L

I

S

V

A

C

I

D

Q

Q

V

V

E

K

Y

Y

H

N

V

I

L

E

-

D

-

R

-

D

L

P

G

E

Q

R

N

D

A

G

L

L

D

E

Y

F

A

C

R

Q

Q

K

Q

N

D

G

L

V

A

T

L

L

T

V

A

A

Y

Y

T

S

P

P

L

L

A

R

R

R

N

T

K

L

V

L

S

S

D

E

I

K

P

T

-

K

-

R

A

T

I

L

R

E

I

I

A

A

A

K

K

N

H

H

G

G

V

A

L

T

P

I

T

Y

Q

Q

V

I

A

M

L

L

K

A

W

W

L

L

D

A

Q

K

P

P

N

N

V

V

A

V

A

A

I

I

P

P

K

K

A

A

S

G

S

R

E

V

P

E

N

H

Q

L

L

R

A

E

N

N

L

L

A

K

A

A

L

T

D

E

V

I

R

K

L

L

D

S

D

E

E

E

D

E

R

M

A

K

L

L

I

L

A

D

S

S

L

L

S

G

binding tolrestat: W22 (= W20), E28 (vs. gap), Y58 (≠ A47), Y59 (= Y48), K85 (= K73), H118 (= H106)

5danA Crystal structure of a novel aldo keto reductase tm1743 from thermotoga maritima in complex with NADP+
34% identity, 92% coverage: 5:258/277 of query aligns to 6:274/274 of 5danA

query
sites
5danA

I

L

N

G

A

R

Q

T

G

G

L

E

N

E

M

I

P

P

K

A

L

L

G

G

L

L

G
|
G

T
|
T

W
|
W

P

G

M

I

L

G

G

G

-

F

-

E

-

T

-

P

-

D

-

Y

-

S

-

R

-

D

E

E

C

M

T

V

R

E

A

L

V

L

E

K

Q

T

A

A

L

I

A

K

L

M

G

G

Y

Y

R

T

H

H

I

I

D
|
D

T

T

A

A

A

E

A

Y

Y
|
Y

-

G

N

H

N

T

E

E

D

E

A

L

V

I

G

G

Q

K

A

A

L

I

A

K

N

D

S

-

P

-

T

F

P

R

R

R

E

E

Q

D

I

L

H

F

V

I

T

V

T

S

K
|
K

V

V

W

W

W

P

D

T

Q

H

L

L

Q

R

P

R

D

D

A

D

M

L

R

L

H

R

S

S

M

L

D

E

R

N

S

T

L

L

K

K

A

R

L

L

R

D

S

T

E

D

Y

Y

V

V

D

D

L

L

F

Y

M

L

L

I

H
|
H

W

W

P

P

T

N

T

P

D

E

W

I

D

P

L

L

P

E

R

E

T

T

I

L

E

S

T

A

L

M

V

A

S

E

F

G

R

V

E

R

Q

Q

G

G

L

L

A

I

R

R

N

Y

I

I

G

G

V

V

A

S

N

N

F

F

P

D

L

R

H

R

L

L

R

E

K

E

V

A

V

I

E

S

E

K

L

S

G

Q

A

E

P

P

L

I

S

V

A

C

I

D

Q
|
Q

V

V

E

K

Y

Y

H

N

V

I

L

E

-

D

-

R

-

D

L

P

G

E

Q

R

N

D

A

G

L

L

D

E

Y

F

A

C

R

Q

Q

K

Q

N

D

G

L

V

A

T

L

L

T

V

A

A

Y
|
Y

T
x
S

P
|
P

L
|
L

A

R

R
|
R

N

T

K

L

V

L

S

S

D

E

I

K

P

T

-

K

-

R

A

T

I

L

R

E

I

I

A

A

A

K

K

N

H

H

G

G

V

A

L

T

P

I

T
x
Y

Q

Q

V

I

A

M

L

L

K

A

W

W

L

L

D

A

Q

K

P

P

N

N

V

V

A

V

A

A

I
|
I

P
|
P

K
|
K

A

A

S
x
G

S
x
R

E

V

P

E

N
x
H

Q

L

L

R

A
x
E

N
|
N

L

L

A

K

A

A

L

T

D

E

V

I

R

K

L

L

D

S

D

E

E

E

D

E

R

M

A

K

L

L

I

L

A

D

S

S

L

L

S

G

active site: D53 (= D43), Y58 (= Y48), K84 (= K73), H117 (= H106)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G19 (= G18), T20 (= T19), W21 (= W20), D53 (= D43), Y58 (= Y48), H117 (= H106), Q169 (= Q158), Y198 (= Y184), S199 (≠ T185), P200 (= P186), L201 (= L187), R203 (= R189), Y226 (≠ T210), I242 (= I226), P243 (= P227), K244 (= K228), G246 (≠ S230), R247 (≠ S231), H250 (≠ N234), E253 (≠ A237), N254 (= N238)

P14065 Glycerol 2-dehydrogenase (NADP(+)); Galactose-inducible crystallin-like protein 1; EC 1.1.1.156 from Saccharomyces cerevisiae (strain ATCC 204508 / S288c) (Baker's yeast) (see 2 papers)
34% identity, 95% coverage: 9:270/277 of query aligns to 17:307/312 of P14065

query
sites
P14065

G

G

L

A

N

Q

M

I

P

P

K

Q

L

I

G

G

L

L

G

G

T

T

W

W

P
x
Q

M

S

L

K

G

E

E

N

E

D

C

A

T

Y

R

K

A

A

V

V

E

L

Q

T

A

A

L

L

A

K

L

D

G

G

Y

Y

R

R

H

H

I

I

D

D

T

T

A

A

A

I

Y
|
Y

N

R

N

N

E

E

D

D

A

Q

V

V

G

G

Q

Q

A

A

L

I

A

K

N

D

S

S

P

G

T

V

P

P

R

R

E

E

Q

E

I

I

H

F

V

V

T

T

K

K

V

L

W

W

W

C

D

T

Q

Q

-

H

L

H

Q

E

P

P

D

E

A

V

M

-

R

-

H

-

S

A

M

L

D

D

R

Q

S

S

L

L

K

K

A

R

L

L

R

G

S

L

E

D

Y

Y

V

V

D

D

L

L

F

Y

M

L

L

M

H

H

W

W

P

P

T

A

-

R

-

L

-

D

-

P

-

A

-

Y

-

I

-

K

-

N

-

E

-

D

-

I

-

L

-

S

-

V

-

P

-

T

-

K

-

D

-

G

-

S

-

R

-

A

-

V

-

D

-

I

T

T

D

N

W

W

D

N

L

F

P

I

R

K

T

T

I

W

E

E

T

L

L

M

V

Q

S

E

F

L

R

P

E

K

Q

T

G

G

L

K

A

T

R

K

N

A

I

V

G

G

V

V

A

S

N

N

F

F

P

S

L

I

H

N

L

N

L

L

R

K

K

D

V

L

E

A

E

S

L

Q

G

G

A

N

P

K

L

L

S

T

-

P

-

A

A

A

I

N

Q

Q

V

V

E

E

Y

I

H

H

V

P

L

L

G

P

Q

Q

N

D

A

E

L

L

L

I

D

N

Y

F

A

C

R

K

Q

S

Q

K

D

G

L

I

A

V

L

V

T

E

A

A

Y

Y

T

S

P

P

L

L

A

G

R

S

N

T

K

D

V

A

S

P

D

L

I

L

-

K

-

E

P

P

A

V

I

I

R

L

R

E

I

I

A

A

A

K

K

K

H

N

G

N

V

V

L

Q

P

P

T

G

Q

H

V

V

A

V

L

I

K

S

W

W

L

H

L

V

D

-

Q

Q

P

R

N

G

V

Y

A

V

I

L

P

P

K
|
K

A

-

S

S

S

V

E
x
N

P

P

N

D

Q
x
R

L

I

A

K

N

T

L

N

A

R

A

K

L

I

D

-

V

F

R

T

L

L

D

S

D

T

E

E

D

D

R

F

A

E

L

A

I

I

A

N

S

N

L

I

S

S

K

K

-

E

-

K

-

G

R

E

E

K

R

R

Q

V

V

V

S

H

P

P

D

N

F

W

A

S

P

P

Q29 (≠ P21) mutation to K: Decreases catalytic activity.
Y56 (= Y48) mutation to L: Loss of catalytic activity.
K264 (= K228) mutation to R: Decreases catalytic activity.
N267 (≠ E232) mutation to Q: Decreases catalytic activity.
R270 (≠ Q235) mutation R->H,Y,K: Decreases catalytic activity.

4gieA Crystal structure of prostaglandin f synthase from trypanosoma cruzi bound to NADP (see paper)
35% identity, 94% coverage: 10:270/277 of query aligns to 21:285/288 of 4gieA

query
sites
4gieA

L

V

N

R

M

M

P

P

K

Q

L

L

G

G

L

L

G
|
G

T

V

W
|
W

-

R

P

A

M

Q

L

D

G

G

E

A

E

E

C

T

T

A

R

N

A

A

V

V

E

R

Q

W

A

A

L

I

A

E

L

A

G

G

Y

Y

R

R

H

H

I

I

D
|
D

T

T

A

A

A

Y

A

I

Y
|
Y

N

S

N

N

E

E

D

R

A

G

V

V

G

G

Q

Q

A

G

L

I

A

R

N

E

S

S

P

G

T

V

P

P

R

R

E

E

Q

E

I

V

H

W

V

V

T

T

K
|
K

V

V

W

W

W

N

D

S

Q

D

L

Q

Q

G

P

Y

D

E

A

K

M

T

R

L

H

A

S

A

M

F

D

E

R

R

S

S

L

R

K

E

A

L

L

L

R

G

S

L

E

E

Y

Y

V

I

D

D

L

L

F

Y

M

L

L

I

H
|
H

W
|
W

P

P

T

G

T

K

D

K

W

-

D

K

L

F

P

V

R

D

T

T

I

W

E

K

T

A

L

L

V

E

S

K

F

L

R

Y

E

E

Q

E

G

K

L

K

A

V

R

R

N

A

I

I

G

G

V

V

A

S

N
|
N

F

F

P

E

L

P

H

H

L

H

L

L

R

T

K

E

V

L

V

F

E

K

E

S

L

C

G

K

A

I

P

R

L

P

S

M

A

V

I

N

Q
|
Q

V

V

E

E

Y

L

H

H

V

P

L

L

L

F

G

Q

Q

Q

N

R

A

T

L

L

L

R

D

E

Y

F

A

C

R

K

Q

Q

Q

H

D

N

L

I

A

A

L

I

T

T

A

A

Y
x
W

T
x
S

P
|
P

L
|
L

A

G

R
x
S

N

G

K

E

V

E

S

A

D

G

I

I

-
x
L

-

K

-

N

P

H

A

V

I

L

R

G

R

E

I

I

A

A

A

K

K

K

H

H

G

N

V

K

L

S

P

P

T
x
A

Q

Q

V

V

A

V

L

I

K

R

W

W

L

D

L

I

D

-

Q

Q

P

H

N

G

V

I

A

V

A

T

I
|
I

P
|
P

K
|
K

A
x
S

S

T

S

N

E

K

P

G

N
x
R

Q

I

L

Q

A
x
E

N
|
N

L

F

A

N

A

V

L

W

D

D

V

F

R

K

L

L

D

T

D

E

E

E

D

E

R

M

A

R

L

Q

I

I

A

D

S

E

L

L

S

N

K

E

R

D

E

K

R

R

-

I

Q

G

V

A

S

D

P

P

D

D

-

N

F

F

A

F

P

P

active site: D55 (= D43), Y60 (= Y48), K85 (= K73), H118 (= H106)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G29 (= G18), W31 (= W20), D55 (= D43), Y60 (= Y48), H118 (= H106), W119 (= W107), N148 (= N137), Q169 (= Q158), W195 (≠ Y184), S196 (≠ T185), P197 (= P186), L198 (= L187), S200 (≠ R189), L207 (vs. gap), A224 (≠ T210), I239 (= I226), P240 (= P227), K241 (= K228), S242 (≠ A229), R247 (≠ N234), E250 (≠ A237), N251 (= N238)

4fziA Crystal structure of prostaglandin f synthase from trypanosoma cruzi (see paper)
35% identity, 94% coverage: 10:270/277 of query aligns to 10:274/277 of 4fziA

query
sites
4fziA

L

V

N

R

M

M

P

P

K

Q

L

L

G

G

L

L

G

G

T

V

W
|
W

-

R

P

A

M

Q

L

D

G

G

E

A

E

E

C

T

T

A

R

N

A

A

V

V

E

R

Q

W

A

A

L

I

A

E

L

A

G

G

Y

Y

R

R

H

H

I

I

D
|
D

T

T

A

A

A

Y

A

I

Y
|
Y

N

S

N

N

E

E

D

R

A

G

V

V

G

G

Q

Q

A

G

L

I

A

R

N

E

S

S

P

G

T

V

P

P

R

R

E

E

Q

E

I

V

H

W

V

V

T

T

K
|
K

V

V

W

W

W

N

D

S

Q

D

L

Q

Q

G

P

Y

D

E

A

K

M

T

R

L

H

A

S

A

M

F

D

E

R

R

S

S

L

R

K

E

A

L

L

L

R

G

S

L

E

E

Y

Y

V

I

D

D

L

L

F

Y

M

L

L

I

H
|
H

W

W

P

P

T

G

T

K

D

K

W

-

D

K

L

F

P

V

R

D

T

T

I

W

E

K

T

A

L

L

V

E

S

K

F

L

R

Y

E

E

Q

E

G

K

L

K

A

V

R

R

N

A

I

I

G

G

V

V

A

S

N

N

F

F

P

E

L

P

H

H

L

H

L

L

R

T

K

E

V

L

V

F

E

K

E

S

L

C

G

K

A

I

P

R

L

P

S

M

A

V

I

N

Q

Q

V

V

E

E

Y

L

H

H

V

P

L

L

L

F

G

Q

Q

Q

N

R

A

T

L

L

L

R

D

E

Y

F

A

C

R

K

Q

Q

Q

H

D

N

L

I

A

A

L

I

T

T

A

A

Y
x
W

T

S

P

P

L

L

A

G

R

S

N

G

K

E

V

E

S

A

D

G

I

I

-

L

-

K

-

N

P

H

A

V

I

L

R

G

R

E

I

I

A

A

A

K

K

K

H

H

G

N

V

K

L

S

P

P

T

A

Q

Q

V

V

A

V

L

I

K

R

W

W

L

D

L

I

D

-

Q

Q

P

H

N

G

V

I

A

V

A

T

I

I

P

P

K

K

A

S

S

T

S

N

E

K

P

G

N

R

Q

I

L

Q

A

E

N

N

L

F

A

N

A

V

L

W

D

D

V

F

R

K

L

L

D

T

D

E

E

E

D

E

R

M

A

R

L

Q

I

I

A

D

S

E

L

L

S

N

K

E

R

D

E

K

R

R

-

I

Q

G

V

A

S

D

P

P

D

D

-

N

F

F

A

F

P

P

active site: D44 (= D43), Y49 (= Y48), K74 (= K73), H107 (= H106)
binding glutamic acid: W20 (= W20), Y49 (= Y48), H107 (= H106), W184 (≠ Y184)

3d3fA Crystal structure of yvgn and cofactor NADPH from bacillus subtilis (see paper)
36% identity, 94% coverage: 9:267/277 of query aligns to 13:269/275 of 3d3fA

query
sites
3d3fA

G

G

L

V

N

E

M

M

P

P

K

W

L

F

G

G

L

L

G
|
G

T

V

W
x
F

P

K

M

V

L

E

-

N

G

G

E

N

E

E

C

A

T

T

R

E

A

S

V

V

E

K

Q

A

A

A

L

I

A

K

L

N

G

G

Y

Y

R

R

H

S

I

I

D
|
D

T

T

A

A

A

I

Y
|
Y

N

K

N

N

E

E

D

E

A

G

V

V

G

G

Q

I

A

G

L

I

A

K

N

E

S

S

P

G

T

V

P

A

R

R

E

E

Q

E

I

L

H

F

V

I

T

T

T

S

K
|
K

V

V

W

W

W

N

D

E

Q

D

L

Q

Q

G

P

Y

D

E

A

T

M

T

R

L

H

A

S

A

M

F

D

E

R

K

S

S

L

L

K

E

A

R

L

L

R

Q

S

L

E

D

Y

Y

V

L

D

D

L

L

F

Y

M

L

L

I

H
|
H

W

W

P

P

T

G

T

K

D

D

W

-

D

K

L

Y

P

K

R

D

T

T

I

W

E

R

T

A

L

L

V

E

S

K

F

L

R

Y

E

K

Q

D

G

G

L

K

A

I

R

R

N

A

I

I

G

G

V

V

A
x
S

N
|
N

F

F

P

Q

L

V

H

H

L

H

L

L

R

E

K

E

V

L

E

K

E

D

L

A

G

E

A

I

P

K

L

P

S

M

A

V

I

N

Q
|
Q

V

V

E

E

Y

F

H

H

V

P

L

R

L

L

G

T

Q

Q

N

K

A

E

L

L

L

R

D

D

Y

Y

A

C

R

K

Q

G

Q

Q

D

G

L

I

A

Q

L

L

T

E

A

A

Y
x
W

T
x
S

P
|
P

L
|
L

A

M

R
x
Q

N

G

K

Q

V

L

S
x
L

D

D

I

N

P

E

A

V

I

L

R

T

R

Q

I

I

A

A

A

E

K

K

H

H

G

N

V

K

L

S

P

V

T

A

Q

Q

V

V

A

I

L

L

K

R

W

W

L

D

L

L

D

-

Q

Q

P

H

N

G

V

V

A

V

A

T

I
|
I

P

P

K
|
K

A
x
S

S

I

S
x
K

E

E

P

H

N
x
R

Q

I

L

I

A
x
E

N
|
N

L

A

A

D

A

I

L

F

D

D

V

F

R

E

L

L

D

S

D

Q

E

E

D

D

R

M

A

D

L

K

I

I

A

D

S

A

L

L

S

N

K

K

R

D

E

E

R

R

Q

-

V

V

S

G

P

P

D

N

active site: D48 (= D43), Y53 (= Y48), K78 (= K73), H111 (= H106)
binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G22 (= G18), F24 (≠ W20), D48 (= D43), Y53 (= Y48), H111 (= H106), S140 (≠ A136), N141 (= N137), Q162 (= Q158), W188 (≠ Y184), S189 (≠ T185), P190 (= P186), L191 (= L187), Q193 (≠ R189), L197 (≠ S193), I229 (= I226), K231 (= K228), S232 (≠ A229), K234 (≠ S231), R237 (≠ N234), E240 (≠ A237), N241 (= N238)

3wbwA Crystal structure of gox0644 in complex with NADPH
32% identity, 94% coverage: 9:267/277 of query aligns to 11:265/271 of 3wbwA

query
sites
3wbwA

G

G

L

H

N

T

M

M

P

P

K

Q

L

I

G

G

L

L

G
|
G

T

V

W

W

P

E

M

T

L

P

G

P

E

D

E

E

C

T

T

A

R

E

A

V

V

V

E

K

Q

E

A

A

L

V

A

K

L

L

G

G

Y

Y

R

R

H

S

I

V

D
|
D

T

T

A

A

A

R

A

L

Y
|
Y

N

K

N

N

E

E

D

E

A

G

V

V

G

G

Q

K

A

G

L

L

A

E

N

D

S

H

P

P

T

-

P

-

R

-

E

-

Q

E

I

I

H

F

V

L

T

T

K
|
K

V

L

W

W

W

N

D

D

Q

E

L

Q

Q

G

P

Y

D

D

A

S

M

T

R

L

H

R

S

A

M

Y

D

E

R

E

S

S

L

A

K

R

A

L

L

L

R

R

S

R

E

P

Y

V

V

L

D

D

L

L

F

Y

M

L

L

I

H
|
H

W

W

P

P

T

M

-

P

T

A

D

Q

W

G

D

Q

L

Y

P

V

R

E

T

T

I

W

E

K

T

A

L

L

V

V

S

E

F

L

R

K

E

K

Q

S

G

G

L

R

A

V

R

K

N

S

I

I

G

G

V

V

A

S

N
|
N

F

F

P

E

L

S

H

E

L

H

L

L

R

E

K

R

V

I

V

M

E

D

E

A

L

T

G

G

A

V

P

V

L

P

S

V

A

V

I

N

Q

Q

V

I

E

E

Y

L

H

H

V

P

L

D

L

F

G

Q

Q

Q

N

R

A

A

L

L

L

R

D

E

Y

F

A

H

R

E

Q

K

Q

H

D

N

L

I

A

R

L

T

T

E

A

S

Y
x
W

T
x
R

P
|
P

L
|
L

A

G

R

K

N

G

K

R

V

V

S
x
L

D

S

I

D

P

E

A

R

I

I

R

G

R

K

I

I

A

A

A

E

K

K

H

H

G

S

V

R

L

T

P

P

T
x
A

Q

Q

V

V

A

V

L

I

K

R

W

W

L

H

L

L

D

-

Q

Q

P

N

N

G

V

L

A

I

A

V

I

I

P

P

K
|
K

A

-

S
|
S

S
x
V

E

N

P

P

N

K

Q
x
R

L

L

A

A

-
x
E

N
|
N

L

L

A

D

A

V

L

F

D

G

V

F

R

V

L

L

D

D

D

A

E

D

D

D

R

M

A

Q

L

A

I

I

A

E

S

Q

L

M

S

D

K

R

R

K

E

D

R

G

Q

R

V

M

S

G

P

A

D

D

active site: D45 (= D43), Y50 (= Y48), K71 (= K73), H104 (= H106)
binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G20 (= G18), H104 (= H106), N136 (= N137), W183 (≠ Y184), R184 (≠ T185), P185 (= P186), L186 (= L187), L192 (≠ S193), A209 (≠ T210), K226 (= K228), S227 (= S230), V228 (≠ S231), R232 (≠ Q235), E235 (vs. gap), N236 (= N238)

P51635 Aldo-keto reductase family 1 member A1; 3-DG-reducing enzyme; Alcohol dehydrogenase [NADP(+)]; Aldehyde reductase; Glucuronate reductase; Glucuronolactone reductase; EC 1.1.1.2; EC 1.1.1.372; EC 1.1.1.54; EC 1.1.1.19; EC 1.1.1.20 from Rattus norvegicus (Rat) (see paper)
30% identity, 93% coverage: 9:266/277 of query aligns to 11:301/325 of P51635

query
sites
P51635

G

G

L

Q

N
x
K

M

M

P

P

K

L

L

I

G

G

L

L

G

G

T

T

W

W

P
x
K

M

S

L

E

G

P

E

G

E

Q

C

V

T
x
K

R

A

A

A

V

I

E
x
K

Q

Y

A

A

L

L

A

S

L

V

G

G

Y

Y

R

R

H

H

I

I

D

D

T

C

A

A

A

S

A

V

Y

Y

N

G

N

N

E

E

D

T

A

E

V

I

G

G

Q

E

A

A

L

L

-
x
K

-

E

-

S

-

V

-

G

A

A

N

G

S
x
K

P

A

T

V

P

P

R

R

E

E

Q

E

I

L

H

F

V

V

T

T

T

S

K
|
K

V

L

W

W

W

N

D

T

Q
x
K

L

H

Q

H

P

P

D

E

A

D

M

V

R

E

H

P

S

A

M

V

D

R

R
x
K

S

T

L

L

K

A

A

D

L

L

R

Q

S

L

E

E

Y

Y

V

L

D

D

L

L

F

Y

M

L

L

M

H

H

W

W

P

P

-

Y

-

A

-

F

-

E

-

R

-

G

-

D

-

N

-

P

-

F

-

P

-
x
K

-

N

-

A

-

D

-

G

T

T

T

V

D
x
K

W

Y

D

D

L

S

P

T

R

H

T

Y

I
x
K

E

E

T

T

-

W

-
x
K

-

A

L

L

V

E

S

A

F

L

R

V

E

A

Q
x
K

G

G

L

L

A

V

R
x
K

N

A

I

L

G

G

V

L

A

S

N

N

F

F

P

S

L

S

H

R

L

Q

L

I

R

D

K

D

V

V

V

L

E

S

E

V

L

A

G

S

A

V

P

R

L

P

S

A

A

V

I

L

Q

Q

V

V

E

E

Y

C

H

H

V

P

L

Y

L

L

G

A

Q

Q

N

N

A

E

L

L

L

I

D

A

Y

H

A

C

R

Q

Q

A

Q

R

D

G

L

L

A

E

L

V

T

T

A

A

Y

Y

T

S

P

P

L

L

A

G

R

S

N

S

K

D

V

R

S

A

-

W

-

R

-

H

-

P

-

D

-

E

-

P

-

V

-

L

D

E

I

E

P

P

A

V

I

V

R

L

R

A

I

L

A

A

A

E

K
|
K

H

H

G

G

V

R

L

S

P

P

T

A

Q

Q

V

I

A

L

L

L

K

R

W

W

L

Q

L

V

D

-

Q

Q

P

R

N
x
K

V

V

A

I

A

C

I

I

P

P

K
|
K

A

S

S

I

S

T

E

P

P

S

N

R

Q

I

L

L

A

Q

N

N

L

I

A

Q

A

V

L

F

D

D

V

F

R

T

L

F

D

S

D

P

E

E

D

E

R

M

A
x
K

L

Q

I

L

A

D

S

A

L

L

S

N

K
|
K

R

N

E

W

R

R

Q

Y

V

I

S

V

P

P

K13 (≠ N11) Not glycated
K23 (≠ P21) modified: carbohydrate, N-linked (Glc) (glycation) lysine
K30 (≠ T28) Not glycated
K34 (≠ E32) Not glycated
K61 (vs. gap) Not glycated
K68 (≠ S61) modified: carbohydrate, N-linked (Glc) (glycation) lysine
K80 (= K73) Not glycated
K85 (≠ Q78) modified: carbohydrate, N-linked (Glc) (glycation) lysine
K97 (≠ R90) Not glycated
K127 (vs. gap) Not glycated
K134 (≠ D111) Not glycated
K141 (≠ I118) modified: carbohydrate, N-linked (Glc) (glycation) lysine
K145 (vs. gap) Not glycated
K153 (≠ Q127) modified: carbohydrate, N-linked (Glc) (glycation) lysine
K157 (≠ R131) Not glycated
K240 (= K204) Not glycated
K257 (≠ N222) Not glycated
K263 (= K228) Not glycated
K287 (≠ A252) Not glycated
K294 (= K259) Not glycated

Sites not aligning to the query:

1 modified: Initiator methionine, Removed
2 modified: N-acetylthreonine
308 Not glycated

Q9JII6 Aldo-keto reductase family 1 member A1; Alcohol dehydrogenase [NADP(+)]; Aldehyde reductase; Glucuronate reductase; Glucuronolactone reductase; EC 1.1.1.2; EC 1.1.1.372; EC 1.1.1.54; EC 1.1.1.19; EC 1.1.1.20 from Mus musculus (Mouse)
30% identity, 93% coverage: 9:266/277 of query aligns to 11:301/325 of Q9JII6

query
sites
Q9JII6

G

G

L

Q

N

K

M

M

P

P

K

L

L

I

G

G

L

L

G

G

T

T

W

W

P

K

M

S

L

E

G

P

E

G

E

Q

C

V

T

K

R

A

A

A

V

I

E

K

Q

H

A

A

L

L

A

S

L

A

G

G

Y

Y

R

R

H

H

I

I

D

D

T

C

A

A

A

S

A

V

Y

Y

N

G

N

N

E

E

D

T

A

E

V

I

G

G

Q

E

A

A

L

L

A

K

N

E

S

S

-

V

-

G

-

S

-

G

-

K

P

A

T

V

P

P

R

R

E

E

Q

E

I

L

H

F

V

V

T

T

T

S

K

K

V

L

W

W

W

N

D

T

Q

K

L

H

Q

H

P

P

D

E

A

D

M

V

R

E

H

P

S

A

M

L

D

R

R

K

S

T

L

L

K

A

A

D

L

L

R

Q

S

L

E

E

Y

Y

V

L

D

D

L

L

F

Y

M

L

L

M

H

H

W

W

P

P

T

Y

T

A

-

F

-

E

-

R

-

G

D

D

W

N

D

P

L

F

P

P

R

K

T

N

I

A

E

D

T

G

L

T

V

V

S

R

F

Y

R

D

E

S

-

T

-

H

-

Y

-

K

-

E

-

T

-

W

-

K

-

A

-

L

-

E

-

V

-

L

-

V

-

A

Q

K

G

G

L

L

A

V

R

K

N

A

I

L

G

G

V

L

A

S

N

N

F

F

P

N

L

S

H

R

L

Q

L

I

R

D

K

D

V

V

V

L

E

S

E

V

L

A

G

S

A

V

P

R

L

P

S

A

A

V

I

L

Q

Q

V

V

E

E

Y

C

H

H

V

P

L

Y

L

L

G

A

Q

Q

N

N

A

E

L

L

L

I

D

A

Y

H

A

C

R

H

Q

A

Q

R

D

G

L

L

A

E

L

V

T

T

A

A

Y

Y

T

S

P

P

L

L

A

G

R

S

N

S

K

D

V

R

S

A

-

W

-

R

-

H

-

P

-

D

-

E

-

P

-

V

-

L

D

E

I

E

P

P

A

V

I

V

R

L

R

A

I

L

A

A

A

E

K

K

H

H

G

G

V

R

L

S

P

P

T

A

Q

Q

V

I

A

L

L

L

K

R

W

W

L

Q

L

V

D

-

Q

Q

P

R

N

K

V

V

A

I

A

C

I

I

P

P

K

K

A

S

S

I

S

N

E

P

P

S

N

R

Q

I

L

L

A

Q

N

N

L

I

A

Q

A

V

L

F

D

D

V

F

R

T

L

F

D

S

D

P

E

E

D

E

R

M

A

K

L

Q

I

L

A

D

S

A

L

L

S

N

K

K

R

N

E

W

R

R

Q

Y

V

I

S

V

P

P

Sites not aligning to the query:

1 modified: Initiator methionine, Removed
2 modified: N-acetylthreonine

4g5dA X-ray crystal structure of prostaglandin f synthase from leishmania major friedlin bound to NADPH (see paper)
34% identity, 94% coverage: 7:267/277 of query aligns to 11:277/283 of 4g5dA

query
sites
4g5dA

A

S

Q

N

G

G

L

V

N

K

M

M

P

P

K

Q

L

F

G

G

L

L

G
|
G

T
x
V

W
|
W

P

Q

M

S

-

P

L

A

G

G

E

E

E

V

C

T

T

E

R

N

A

A

V

V

E

K

Q

W

A

A

L

L

A

C

L

A

G

G

Y

Y

R

R

H

H

I

I

D
|
D

T

T

A

A

A

I

Y
|
Y

N

K

N

N

E

E

D

E

A

S

V

V

G

G

Q

A

A

G

L

L

A

R

N

A

S

S

P

G

T

V

P

P

R

R

E

E

Q

D

I

V

H

F

V

I

T

T

K
|
K

V

L

W

W

W

N

D

T

Q

E

L

Q

Q

G

P

Y

D

E

A

S

M

T

R

L

H

A

S

A

M

F

D

E

R

E

S

S

L

R

K

Q

A

K

L

L

R

G

S

V

E

D

Y

Y

V

I

D

D

L

L

F

Y

M

L

L

I

H
|
H

W

W

P

P

T

R

T

G

D

K

-

D

-

I

-

L

-

S

-

K

-

E

-

G

-

K

-

Y

W

L

D

D

L

S

P

W

R

R

T

A

I

F

E

E

T

Q

L

L

V

-

S

-

F

Y

R

K

E

E

Q

K

G

K

L

V

A

-

R

R

N

A

I

I

G

G

V

V

A
x
S

N
|
N

F

F

P

H

L

I

H

H

L

H

L

L

R

E

K

D

V

V

V

L

E

A

E

M

L

C

G

T

A

V

P

T

L

P

S

M

A

V

I

N

Q
|
Q

V

V

E

E

Y

L

H

H

V

P

L

L

L

N

G

N

Q

Q

N

A

A

D

L

L

L

R

D

A

Y

F

A

C

R

D

Q

A

Q

K

D

Q

L

I

A

K

L

V

T

E

A

A

Y
x
W

T
x
S

P
|
P

L
|
L

A

G

R
x
Q

N
x
G

K

K

V

L

S
x
L

D

S

I

N

P

P

A

I

I

L

R

S

R

A

I

I

A

G

A

A

K

K

H

Y

G

N

V

K

L

T

P

A

T

A

Q

Q

V

V

A

I

L

L

K

R

W

W

L

N

L

I

D

-

Q

Q

P

K

N

N

V

L

A

I

A

T

I
|
I

P
|
P

K
|
K

A
x
S

S
x
V

S
x
H

E

R

P

E

N
x
R

Q

I

L

E

A
x
E

N
|
N

L

A

A

D

A

I

L

F

D

D

V

F

R

E

L

L

D

G

D

A

E

E

D

D

R

V

A

M

L

S

I

I

A

D

S

A

L

L

S

N

K

T

R

N

E

S

R

R

Q

-

V

Y

S

G

P

P

D

D

active site: D48 (= D43), Y53 (= Y48), K78 (= K73), H111 (= H106)
binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G22 (= G18), V23 (≠ T19), W24 (= W20), D48 (= D43), Y53 (= Y48), H111 (= H106), S148 (≠ A136), N149 (= N137), Q170 (= Q158), W196 (≠ Y184), S197 (≠ T185), P198 (= P186), L199 (= L187), Q201 (≠ R189), G202 (≠ N190), L205 (≠ S193), I237 (= I226), P238 (= P227), K239 (= K228), S240 (≠ A229), V241 (≠ S230), H242 (≠ S231), R245 (≠ N234), E248 (≠ A237), N249 (= N238)

5z6tA Crystal structure of d-xylose reductase from scheffersomyces stipitis in complex with NADPH (see paper)
31% identity, 93% coverage: 9:266/277 of query aligns to 8:307/317 of 5z6tA

query
sites
5z6tA

G

G

L

Y

N

D

M

M

P

P

K

A

L

V

G

G

L

F

G
|
G

T
x
C

W
|
W

P

K

M

V

L

D

G

V

E

D

E

T

C

C

T

S

R

E

A

Q

V

I

E

Y

Q

R

A

A

L

I

A

K

L

T

G

G

Y

Y

R

R

H

L

I

F

D
|
D

T

G

A

A

A

E

A

D

Y
|
Y

N

A

N

N

E

E

D

K

A

L

V

V

G

G

-

A

-

G

-

V

-

K

Q

K

A

A

L

I

A

D

N

E

S

G

P

I

T

V

P

K

R

R

E

E

Q

D

I

L

H

F

V

L

T

T

T

S

K

K

V

L

W

W

W

N

D

N

Q

Y

L

H

Q

H

P

P

D

D

A

N

M

V

R

E

H

K

S

A

M

L

D

N

R

R

S

T

L

L

K

S

A

D

L

L

R

Q

S

V

E

D

Y

Y

V

V

D

D

L

L

F

F

M

L

L

I

H
|
H

W

F

P

P

T

V

T

T

-

F

-

K

-

F

-

V

-

P

-

L

-

E

-

K

-

Y

-

P

-

G

-

F

-

Y

-

C

-

G

-

K

-

G

-

D

-

N

-

F

D

D

W

Y

-

E

D

D

L

V

P

P

-

I

-

L

R

E

T

T

I

W

E

K

T

A

L

L

V

E

S

K

F

L

R

V

E

K

Q

A

G

G

L

K

A

I

R

R

N

S

I

I

G

G

V

V

A
x
S

N

N

F

F

P

P

L

G

H

A

L

L

R

L

K

D

V

L

E

R

E

G

L

A

G

T

A

I

P

K

L

P

S

S

A

V

I

L

Q
|
Q

V

V

E

E

Y

H

H

H

V

P

L

Y

L

L

G

Q

Q

Q

N

P

A

R

L

L

L

I

D

E

Y

F

A

A

R

Q

Q

S

Q

R

D

G

L

I

A

A

L

V

T

T

A

A

Y
|
Y

T
x
S

P

S

L
x
F

A

G

R

P

N
x
Q

K
x
S

V

F

S

V

D
x
E

I

L

-

N

-

Q

-

G

-

R

-

A

-

L

-

N

-

T

-

S

-

P

-

L

-
x
F

-

E

-

N

P

E

A

T

I

I

R

K

R

A

I

I

A

A

K

K

H

H

G

G

V

K

L

S

P

P

T
x
A

Q

Q

V

V

A

L

L

L

K

R

W

W

L

-

L

S

D

S

Q

Q

P

R

N

G

V

I

A

A

A

I

I
|
I

P
|
P

K
|
K

A

S

S
x
N

S

T

E

V

P

P

N
x
R

Q

L

L

L

A
x
E

N
|
N

L

K

A

D

A

V

L

N

D

S

V

F

R

D

L

L

D

D

D

E

E

Q

D

D

R

F

A

A

L

D

I

I

A

A

S

K

L

L

S

D

K

I

R

N

E

L

R

R

Q

F

V
x
N

S

D

P

P

binding nadp nicotinamide-adenine-dinucleotide phosphate: G17 (= G18), C18 (≠ T19), W19 (= W20), D42 (= D43), Y47 (= Y48), H109 (= H106), S164 (≠ A136), Q186 (= Q158), Y212 (= Y184), S213 (≠ T185), F215 (≠ L187), Q218 (≠ N190), S219 (≠ K191), E222 (≠ D194), F235 (vs. gap), A252 (≠ T210), I267 (= I226), P268 (= P227), K269 (= K228), N271 (≠ S230), R275 (≠ N234), E278 (≠ A237), N279 (= N238), N305 (≠ V264)

7s5fB Crystal structure of mannose-6-phosphate reductase from celery (apium graveolens) leaves with NADP+ and mannonic acid bound (see paper)
30% identity, 96% coverage: 8:272/277 of query aligns to 7:303/309 of 7s5fB

query
sites
7s5fB

Q

S

G

G

L

F

N

K

M

M

P

P

K

V

L

L

G

G

L

L

G
|
G

T
x
V

W
|
W

P

R

M

M

L

D

G

R

E

N

E

E

C

I

T

K

R

N

A

L

V

L

E

L

Q

S

A

A

L

I

A

N

L

L

G

G

Y

Y

R

R

H

H

I

F

D
|
D

T

C

A

A

A
x
D

Y
|
Y

N

K

N

N

E

E

D

L

A

E

V

V

G

G

Q

E

A

A

L

F

A

K

N

E

S

A

P

F

-

D

-

T

-

D

-

L

T

V

P

K

R

R

E

E

Q

D

I

L

H

F

V

I

T

T

K

K

V

L

W
|
W

W

-

D

-

Q

N

L

S

Q

D

P

H

D

G

A

H

M

V

R

I

H

E

S

A

M

C

D

K

R

N

S

S

L

L

K

K

A

K

L

L

R

Q

S

L

E

E

Y

Y

V

L

D

D

L

L

F

Y

M

L

L

I

H
|
H

W

F

P

P

T

M

-

A

-

S

-

K

-

H

-

S

-

G

-

I

-

G

-

T

-

R

-

S

-

I

-

L

-

D

-

E

-

G

-

V

-

L

-

E

-

V

-

D

T

T

D

T

W

I

D

S

L

L

P

E

R

A

T

T

I

W

E

H

T

E

L

M

V

E

S

K

F

L

R

V

E

E

Q

M

G

G

L

L

A

V

R

R

N

S

I

I

G

G

V

I

A

S

N
|
N

F

Y

P

D

L

V

H

Y

L

L

L

T

R

R

K

D

V

I

V

L

E

S

E

Y

L

S

G

K

A

I

P

K

L

P

S

A

A

V

I

N

Q
|
Q

V

I

E

E

Y

T

H

H

V

P

L

Y

L

F

G

Q

Q

R

N

D

A

S

L

L

L

I

D

K

Y

F

A

C

R

H

Q

K

Q

Y

D

G

L

I

A

A

L

I

T

T

A

A

Y
x
H

T
|
T

P
|
P

L
|
L

A

G

R
x
G

-
x
A

-

L

-

A

-

N

-

T

-

E

-

R

-

F

N

G

K

S

V

V

S

S

-

C

-

L

D

D

I

D

P

P

A

V

I

L

R

K

I

L

A

S

A

D

K

K

H

H

G

N

V

K

L

S

P

P

T
x
A

Q

Q

V

I

A

V

L

L

K

R

W

W

L

G

L

V

D

-

Q

Q

P

R

N

N

V

T

A

I

A

V

I
|
I

P

P

K
|
K

A
x
S

S
|
S

S

K

E

T

P

K

N
x
R

Q

L

L

E

A
x
E

N
|
N

L

L

A

N

A

I

L

F

D

D

V

F

R

E

L

L

D

S

D

K

E

E

D

D

R

M

A

E

L

L

I

I

A

K

S

T

L

M

S

E

K

R

R

N

E

Q

R

R

Q

S

V

N

S

T

P

P

D

-

F

-

A

A

P

K

V

A

W

W

binding d-mannonic acid: W19 (= W20), D46 (≠ A47), Y47 (= Y48), W78 (= W75), H107 (= H106)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G17 (= G18), V18 (≠ T19), W19 (= W20), D42 (= D43), Y47 (= Y48), N161 (= N137), Q182 (= Q158), H208 (≠ Y184), T209 (= T185), P210 (= P186), L211 (= L187), G213 (≠ R189), A214 (vs. gap), A244 (≠ T210), I259 (= I226), K261 (= K228), S262 (≠ A229), S263 (= S230), R267 (≠ N234), E270 (≠ A237), N271 (= N238)

P14550 Aldo-keto reductase family 1 member A1; Alcohol dehydrogenase [NADP(+)]; Aldehyde reductase; Glucuronate reductase; Glucuronolactone reductase; EC 1.1.1.2; EC 1.1.1.372; EC 1.1.1.54; EC 1.1.1.19; EC 1.1.1.20 from Homo sapiens (Human) (see 3 papers)
29% identity, 93% coverage: 9:266/277 of query aligns to 11:301/325 of P14550

query
sites
P14550

G

G

L

Q

N

K

M

M

P

P

K

L

L

I

G

G

L

L

G

G

T

T

W

W

P

K

M

S

L

E

G

P

E

G

E

Q

C

V

T

K

R

A

A

A

V

V

E

K

Q

Y

A

A

L

L

A

S

L

V

G

G

Y

Y

R

R

H

H

I

I

D

D

T

C

A

A

A

I

Y
|
Y

N

G

N
|
N

E

E

D

P

A
x
E

V

I

G

G

Q

E

A

A

L

L

A

K

-

E

-

D

-

V

-

G

-

P

N

G

S

K

P

A

T

V

P

P

R

R

E

E

Q

E

I

L

H

F

V

V

T

T

T

S

K
|
K

V

L

W

W

W

N

D

T

Q

K

L

H

Q

H

P

P

D

E

A

D

M

V

R

E

H

P

S

A

M

L

D

R

R

K

S

T

L

L

K

A

A

D

L

L

R

Q

S

L

E

E

Y

Y

V

L

D

D

L

L

F

Y

M

L

L

M

H
|
H

W

W

P

P

T

Y

T

A

-

F

-

E

-

R

-

G

D

D

W

N

D

P

L

F

P

P

R

K

T

N

I

A

E

D

T

G

L

T

V

I

S

C

F

Y

R

D

E

S

-

T

-

H

-

Y

-

K

-

E

-

T

-

W

-

K

-

A

-

L

-

E

-

A

-

L

-

V

-

A

Q

K

G

G

L

L

A

V

R

Q

N

A

I

L

G

G

V

L

A

S

N

N

F

F

P

N

L

S

H

R

L

Q

L

I

R

D

K

D

V

I

V

L

E

S

E

V

L

A

G

S

A

V

P

R

L

P

S

A

A

V

I

L

Q

Q

V

V

E

E

Y

C

H

H

V

P

L

Y

L

L

G

A

Q

Q

N

N

A

E

L

L

L

I

D

A

Y

H

A

C

R

Q

Q

A

Q

R

D

G

L

L

A

E

L

V

T

T

A

A

Y

Y

T

S

P

P

L

L

A

G

R

S

N

S

K

D

V

R

S

A

-

W

-

R

-

D

-

P

-

D

-

E

-

P

-

V

-

L

D

E

I

E

P

P

A

V

I

V

R

L

R

A

I

L

A

A

A

E

K

K

H

Y

G

G

V

R

L

S

P

P

T

A

Q

Q

V

I

A

L

L

L

K

R

W

W

L

Q

L

V

D

-

Q

Q

P

R

N

K

V

V

A

I

A

C

I

I

P

P

K

K

A

S

S

I

S

T

E

P

P

S

N

R

Q

I

L

L

A

Q

N

N

L

I

A

K

A

V

L

F

D

D

V

F

R

T

L

F

D

S

D

P

E

E

D

E

R

M

A

K

L

Q

I

L

A

N

S

A

L

L

S

N

K

K

R

N

E

W

R

R

Q

Y

V
x
I

S
x
V

P

P

Y50 (= Y48) active site, Proton donor; mutation to F: Complete loss of enzymatic activity.; mutation to H: Complete loss of enzymatic activity.
N52 (= N50) to S: reduced activity towards daunorubicin; dbSNP:rs2229540
E55 (≠ A53) to D: reduced activity towards daunorubicin; dbSNP:rs6690497
K80 (= K73) Lowers pKa of active site Tyr; mutation to M: Complete loss of enzymatic activity.
H113 (= H106) binding ; mutation to Q: Strong decrease in enzymatic activity.
I299 (≠ V264) mutation to A: No change in enzymatic activity.; mutation to C: No change in enzymatic activity.
V300 (≠ S265) mutation to C: No change in enzymatic activity.

Sites not aligning to the query:

1 modified: Initiator methionine, Removed

A0QV09 Aldo-keto reductase MSMEG_2407/MSMEI_2346; AKR; AKR5H1; EC 1.1.1.- from Mycolicibacterium smegmatis (strain ATCC 700084 / mc(2)155) (Mycobacterium smegmatis) (see paper)
35% identity, 91% coverage: 12:262/277 of query aligns to 22:272/283 of A0QV09

query
sites
A0QV09

M

L

P

P

K

V

L

V

G

G

L

I

G

G

T

V

W

G

P

E

M

L

L

S

G

D

E

S

E

E

C

A

T

E

R

R

A

S

V

V

E

S

Q

A

A

A

L

L

A

E

L

A

G

G

Y

Y

R

R

H

L

I

I

D

D

T

T

A

A

Y

Y

N

G

N

N

E

E

D

A

A

A

V

V

G

G

Q

R

A

A

L

I

A

A

N

A

S

S

P

G

T

I

P

P

R

R

E

D

Q

E

I

I

H

Y

V

V

T

T

K

K

V

L

W

A

W

T

D

P

Q

D

L

Q

Q

G

P

F

D

T

A

S

M

S

R

Q

H

A

S

A

M

A

D

R

R

A

S

S

L

L

K

E

A

R

L

L

R

G

S

L

E

D

Y

Y

V

V

D

D

L

L

F

Y

M

L

L

I

H

H

W

W

P

P

T

-

D

G

W

G

D

D

L

T

P

S

R

K

T

Y

I

V

E

D

T

S

-

W

-

G

L

L

V

M

S

K

F

V

R

K

E

E

Q

D

G

G

L

I

A

A

R

R

N

S

I

I

G

G

V

V

A

C

N

N

F

F

P

G

L

A

H

E

L

D

L

L

R

E

K

T

V

I

V

V

E

S

E

L

L

T

G

Y

A

F

P

T

L

P

S

A

A

V

I

N

Q

Q

V

I

E

E

Y

L

H

H

V

P

L

L

G

N

Q

Q

N

A

A

A

L

L

L

R

D

E

Y

V

A

N

R

A

Q

G

Q

Y

D

N

L

I

A

V

L

T

T

E

A

A

Y

Y

T
x
G

P

P

L
|
L

A

G

R
x
V

N

G

K

R

V

L

S

L

D

D

I

H

P

P

A

A

I

V

R

T

R

A

I

I

A

A

A

E

K

A

H

H

G

G

V

R

L

T

P

A

T

A

Q

Q

V

V

A

L

L

L

K

R

W

W

L

S

L

I

D

Q

Q

L

P

G

N

N

V

V

A

-

I

V

P
x
I

K

S

A
x
R

S
|
S

S
x
A

E

N

P

P

N

E

Q
x
R

L

I

A

A

-
x
S

N
|
N

L

L

A

D

A

V

L

F

D

G

V

F

R

E

L

L

D

T

D

A

E

D

D

E

R

M

A

E

L

T

I

L

A

N

S

G

L

L

S

D

K

D

R

G

E

T

R

R

G196 (≠ T185) binding
L198 (= L187) binding
V200 (≠ R189) binding
I236 (≠ P227) binding
R238 (≠ A229) binding
S239 (= S230) binding
A240 (≠ S231) binding
R244 (≠ Q235) binding
S247 (vs. gap) binding
N248 (= N238) binding

Sites not aligning to the query:

274 binding

2wzmA Crystal structure of a mycobacterium aldo-keto reductase in its apo and liganded form (see paper)
35% identity, 91% coverage: 12:262/277 of query aligns to 13:263/274 of 2wzmA

query
sites
2wzmA

M

L

P

P

K

V

L

V

G

G

L

I

G

G

T

V

W

G

P

E

M

L

L

S

G

D

E

S

E

E

C

A

T

E

R

R

A

S

V

V

E

S

Q

A

A

A

L

L

A

E

L

A

G

G

Y

Y

R

R

H

L

I

I

D
|
D

T

T

A

A

Y
|
Y

N

G

N

N

E

E

D

A

A

A

V

V

G

G

Q

R

A

A

L

I

A

A

N

A

S

S

P

G

T

I

P

P

R

R

E

D

Q

E

I

I

H

Y

V

V

T

T

K
|
K

V

L

W

A

W

T

D

P

Q

D

L

Q

Q

G

P

F

D

T

A

S

M

S

R

Q

H

A

S

A

M

A

D

R

R

A

S

S

L

L

K

E

A

R

L

L

R

G

S

L

E

D

Y

Y

V

V

D

D

L

L

F

Y

M

L

L

I

H
|
H

W

W

P

P

T

-

D

G

W

G

D

D

L

T

P

S

R

K

T

Y

I

V

E

D

T

S

-

W

-

G

L

L

V

M

S

K

F

V

R

K

E

E

Q

D

G

G

L

I

A

A

R

R

N

S

I

I

G

G

V

V

A

C

N

N

F

F

P

G

L

A

H

E

L

D

L

L

R

E

K

T

V

I

V

V

E

S

E

L

L

T

G

Y

A

F

P

T

L

P

S

A

A

V

I

N

Q

Q

V

I

E

E

Y

L

H

H

V

P

L

L

G

N

Q

Q

N

A

A

A

L

L

L

R

D

E

Y

V

A

N

R

A

Q

G

Q

Y

D

N

L

I

A

V

L

T

T

E

A

A

Y
|
Y

T
x
G

P
|
P

L
|
L

A
x
G

R
x
V

N
x
G

K

R

V

L

S
x
L

D

D

I

H

P

P

A

A

I

V

R

T

R

A

I

I

A

A

A

E

K

A

H

H

G

G

V

R

L

T

P

A

T
x
A

Q

Q

V

V

A

L

L

L

K

R

W

W

L

S

L

I

D

Q

Q

L

P

G

N

N

V

V

A

-

I

V

P
x
I

K

S

A
x
R

S
|
S

S

A

E

N

P

P

N

E

Q
x
R

L

I

A

A

-

S

N
|
N

L

L

A

D

A

V

L

F

D

G

V

F

R

E

L

L

D

T

D

A

E

D

D

E

R

M

A

E

L

T

I

L

A

N

S

G

L

L

S

D

K

D

R

G

E

T

R

R

active site: D44 (= D43), Y49 (= Y48), K74 (= K73), H107 (= H106)
binding [(2r,3r,4r,5r)-5-(6-amino-9h-purin-9-yl)-3-hydroxy-4-(phosphonooxy)tetrahydrofuran-2-yl]methyl [(2r,3s,4s)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate: Y186 (= Y184), G187 (≠ T185), P188 (= P186), L189 (= L187), G190 (≠ A188), V191 (≠ R189), G192 (≠ N190), L195 (≠ S193), A212 (≠ T210), I227 (≠ P227), R229 (≠ A229), S230 (= S230), R235 (≠ Q235), N239 (= N238)

Sites not aligning to the query:

binding [(2r,3r,4r,5r)-5-(6-amino-9h-purin-9-yl)-3-hydroxy-4-(phosphonooxy)tetrahydrofuran-2-yl]methyl [(2r,3s,4s)-3,4-dihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate: 265

3h4gA Structure of aldehyde reductase holoenzyme in complex with potent aldose reductase inhibitor fidarestat: implications for inhibitor binding and selectivity (see paper)
30% identity, 93% coverage: 9:266/277 of query aligns to 11:301/320 of 3h4gA

query
sites
3h4gA

G

G

L

Q

N

K

M

M

P

P

K

L

L

I

G

G

L

L

G
|
G

T
|
T

W
|
W

P

K

M

S

L

E

G

P

E

G

E

Q

C

V

T

K

R

A

A

A

V

I

E

K

Q

Y

A

A

L

L

A

T

L

V

G

G

Y

Y

R

R

H

H

I

I

D
|
D

T

C

A

A

A

I

Y
|
Y

N

G

N

N

E

E

D

L

A

E

V

I

G

G

Q

E

A

A

L

L

A

Q

N

E

S

T

-

V

-

G

-

P

-

G

-

K

P

A

T

V

P

P

R

R

E

E

Q

E

I

L

H

F

V

V

T

T

T

S

K
|
K

V

L

W

W

W

N

D

T

Q

K

L

H

Q

H

P

P

D

E

A

D

M

V

R

E

H

P

S

A

M

L

D

R

R

K

S

T

L

L

K

A

A

D

L

L

R

Q

S

L

E

E

Y

Y

V

L

D

D

L

L

F

Y

M

L

L

M

H
|
H

W
|
W

P

P

T

Y

T

A

-

F

-

E

-

R

-

G

D

D

W

N

D

P

L

F

P

P

R

K

-

N

-

A

-

D

-

G

-

T

-

I

-

R

-

Y

-

D

-

A

-

T

-

H

-

Y

-

K

-

D

T

T

I

W

E

K

T

A

L

L

V

E

S

A

F

L

R

V

E

A

Q

K

G

G

L

L

A

V

R

R

N

A

I

L

G

G

V

L

A
x
S

N
|
N

F

F

P

S

L

S

H

R

L

Q

L

I

R

D

K

D

V

V

V

L

E

S

E

V

L

A

G

S

A

V

P

R

L

P

S

A

A

V

I

L

Q
|
Q

V

V

E

E

Y

C

H

H

V

P

L

Y

L

L

G

A

Q

Q

N

N

A

E

L

L

L

I

D

A

Y

H

A

C

R

Q

Q

A

Q

R

D

G

L

L

A

E

L

V

T

T

A

A

Y
|
Y

T
x
S

P
|
P

L
|
L

A

G

R
x
S

N

S

K
x
D

V

R

S

A

-
x
W

-

R

-

D

-

P

-

N

-

E

-

P

-

V

-

L

D

E

I

E

P

P

A

V

I

V

R

Q

R

A

I

L

A

A

A

E

K

K

H

Y

G

N

V

R

L

S

P

P

T
x
A

Q

Q

V

I

A

L

L

L

K

R

W

W

L

Q

L

V

D

-

Q

Q

P

R

N

K

V

V

A

I

A

C

I
|
I

P
|
P

K
|
K

A
x
S

S
x
V

S
x
T

E

P

P

S

N
x
R

Q

I

L

L

A
x
Q

N
|
N

L

I

A

Q

A

V

L

F

D

D

V

F

R

T

L

F

D

S

D

P

E

E

D

E

R

M

A

K

L

Q

I

L

A

D

S

A

L

L

S

N

K

K

R

N

E

L

R

R

Q

F

V
x
I

S
x
V

P
|
P

active site: D45 (= D43), Y50 (= Y48), K80 (= K73), H113 (= H106)
binding (2s,4s)-2-aminoformyl-6-fluoro-spiro[chroman-4,4'-imidazolidine]-2',5'-dione: W22 (= W20), Y50 (= Y48), H113 (= H106), W114 (= W107), W220 (vs. gap), I299 (≠ V264), V300 (≠ S265), P301 (= P266)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G20 (= G18), T21 (= T19), W22 (= W20), D45 (= D43), Y50 (= Y48), H113 (= H106), S162 (≠ A136), N163 (= N137), Q184 (= Q158), Y210 (= Y184), S211 (≠ T185), P212 (= P186), L213 (= L187), S215 (≠ R189), D217 (≠ K191), A246 (≠ T210), I261 (= I226), P262 (= P227), K263 (= K228), S264 (≠ A229), V265 (≠ S230), T266 (≠ S231), R269 (≠ N234), Q272 (≠ A237), N273 (= N238)

Query Sequence

>PfGW456L13_1417 FitnessBrowser__pseudo13_GW456_L13:PfGW456L13_1417
MQHIINAQGLNMPKLGLGTWPMLGEECTRAVEQALALGYRHIDTAAAYNNEDAVGQALAN
SPTPREQIHVTTKVWWDQLQPDAMRHSMDRSLKALRSEYVDLFMLHWPTTDWDLPRTIET
LVSFREQGLARNIGVANFPLHLLRKVVEELGAPLSAIQVEYHVLLGQNALLDYARQQDLA
LTAYTPLARNKVSDIPAIRRIAAKHGVLPTQVALKWLLDQPNVAAIPKASSEPNQLANLA
ALDVRLDDEDRALIASLSKRERQVSPDFAPVWDAFDE

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