SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing Echvi_2940 Echvi_2940 Dehydrogenases with different specificities (related to short-chain alcohol dehydrogenases) 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)

5itvA Crystal structure of bacillus subtilis bacc dihydroanticapsin 7- dehydrogenase in complex with nadh (see paper)
37% identity, 98% coverage: 1:246/251 of query aligns to 5:252/255 of 5itvA

query
sites
5itvA

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active site: G18 (= G14), S141 (= S135), Y154 (= Y148), K158 (= K152)
binding 1,4-dihydronicotinamide adenine dinucleotide: G14 (= G10), S17 (= S13), G18 (= G14), I19 (= I15), D38 (= D34), I39 (≠ Y35), T61 (≠ G59), I63 (≠ V61), N89 (= N84), G91 (= G86), T139 (≠ M133), S141 (= S135), Y154 (= Y148), K158 (= K152), P184 (= P178), G185 (= G179), I186 (≠ R180), I187 (≠ V181)

4bmsF Short chain alcohol dehydrogenase from ralstonia sp. Dsm 6428 in complex with NADPH
37% identity, 99% coverage: 1:249/251 of query aligns to 4:249/249 of 4bmsF

query
sites
4bmsF

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active site: S137 (= S135), H147 (≠ R145), Y150 (= Y148), K154 (= K152), Q195 (≠ N193)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G13 (= G10), N15 (≠ A12), S16 (= S13), I18 (= I15), R38 (≠ Y35), R39 (≠ D36), A59 (≠ G59), D60 (= D60), V61 (= V61), N87 (= N84), S88 (≠ A85), G89 (= G86), V110 (= V107), S137 (= S135), Y150 (= Y148), K154 (= K152), G181 (= G179), I183 (≠ V181), T185 (= T183), I187 (≠ F185)

6ihhA Crystal structure of rasadh f12 from ralstonia.Sp in complex with NADPH and a6o
37% identity, 99% coverage: 1:249/251 of query aligns to 4:249/249 of 6ihhA

query
sites
6ihhA

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binding (2R,3S)-2-ethyl-2-[(2E)-2-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)ethyl]-3-oxidanyl-cyclopentan-1-one: S137 (= S135), H147 (≠ R145), Y150 (= Y148), L188 (= L190), L246 (≠ F246)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G13 (= G10), N15 (≠ A12), S16 (= S13), G17 (= G14), I18 (= I15), R38 (≠ Y35), R39 (≠ D36), D60 (= D60), V61 (= V61), N87 (= N84), S88 (≠ A85), G89 (= G86), V110 (= V107), T135 (≠ M133), S137 (= S135), Y150 (= Y148), K154 (= K152), P180 (= P178), G181 (= G179), A182 (≠ R180), I183 (≠ V181), T185 (= T183), S187 (≠ F185)

6ixmC Crystal structure of the ketone reductase chkred20 from the genome of chryseobacterium sp. Ca49 complexed with NAD (see paper)
34% identity, 98% coverage: 1:246/251 of query aligns to 3:245/248 of 6ixmC

query
sites
6ixmC

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active site: G16 (= G14), S142 (= S135), Y155 (= Y148), K159 (= K152)
binding nicotinamide-adenine-dinucleotide: G12 (= G10), S15 (= S13), G16 (= G14), I17 (= I15), D36 (= D34), I37 (≠ Y35), A61 (≠ G59), D62 (= D60), T63 (≠ V61), N89 (= N84), A90 (= A85), M140 (= M133), S142 (= S135), Y155 (= Y148), K159 (= K152), P185 (= P178), A186 (≠ G179), Y187 (≠ R180), I188 (≠ V181), L192 (≠ F185)

6xewA Structure of serratia marcescens 2,3-butanediol dehydrogenase (see paper)
37% identity, 97% coverage: 3:245/251 of query aligns to 5:240/251 of 6xewA

query
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6xewA

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F

C

C

S

S

L

K

A

F

S

A

L

L

P

P

K

H

M

L

K

L

E

K

K

T

G

K

G

G

S

C

I

I

I

V

N

N

M
x
T

A

A

S
|
S

V

V

A
x
S

S

G

T

L

M

G

G

G

L

D

P

W

D

G

R

A

F

A

A

Y

Y
|
Y

S

C

M

A

T

A

K
|
K

G

G

A

A

V

V

F

V

S

N

M

L

T

T

L

R

S

A

M

M

A

A

R

L

D

D

Y

H

V

G

E

G

Y

D

N

G

I

V

R

R

V

I

N

N

S

S

I

V

A

C

P

P

G
x
S

R
x
L

V
|
V

H

K

T
|
T

P
x
N

F
x
M

V
x
T

D

N

G

G

F

-

L

-

A

-

K

-

N

-

Y

W

P

P

G

-

K

-

E

-

K

Q

E

E

M

I

F

R

D

D

K

K

L

F

A

N

A

E

T

R

Q

I

P

A

I

L

G

G

R

R

M

A

G

A

K

E

P

P

E

E

I

V

A

A

M

V

A

M

V

A

Y

F

L

L

S

A

S

S

D

D

E

D

A

A

S

S

F

F

L

I

T

N

G

G

G

A

N

N

Y

I

P

P

I

V

D

D

G

G

active site: G16 (= G14), S138 (= S135), Y151 (= Y148)
binding r,3-hydroxybutan-2-one: S138 (= S135), S140 (≠ A137), Y151 (= Y148)
binding s,3-hydroxybutan-2-one: S138 (= S135), Y151 (= Y148), S182 (≠ G179)
binding nicotinamide-adenine-dinucleotide: G12 (= G10), N15 (≠ S13), G16 (= G14), M17 (≠ I15), D36 (= D34), W37 (≠ Y35), W37 (≠ Y35), A38 (≠ D36), I59 (≠ G59), D60 (= D60), V61 (= V61), N87 (= N84), A88 (= A85), G89 (= G86), V110 (= V107), T136 (≠ M133), S138 (= S135), Y151 (= Y148), K155 (= K152), S182 (≠ G179), L183 (≠ R180), V184 (= V181), T186 (= T183), N187 (≠ P184), M188 (≠ F185), T189 (≠ V186)

H9XP47 Meso-2,3-butanediol dehydrogenase; BDH; meso-2,3-BDH; (R,S)-butane-2,3-diol dehydrogenase; NAD(H)-dependent meso-2,3-BDH; SmBdh; EC 1.1.1.- from Serratia marcescens (see paper)
37% identity, 97% coverage: 3:245/251 of query aligns to 5:240/251 of H9XP47

query
sites
H9XP47

N

N

K

K

T

V

I

V

L

V

I

I

T

T

G

G

G

A

A

G

S
x
N

G

G

I
x
M

G

G

L

E

A

A

M

A

T

A

K

R

R

R

F

F

A

S

E

A

E

E

G

G

G

A

N

I

V

V

Y

V

F

L

I

A

D
|
D

Y

W

D

A

Q

K

K

E

T

A

G

V

E

D

K

K

V

V

A

A

E

A

E

S

L

L

T

-

S

P

K

K

G

G

H

-

R

R

V

A

T

M

F

A

L

V

Q

H

G

I

D
|
D

V
|
V

S

S

Q

D

-

H

-

V

-

A

T

V

E

E

E

K

M

M

K

M

Q

N

T

E

I

V

S

A

S

E

I

K

S

L

G

G

S

R

I

I

D

D

V

V

L

L

V

L

N

N

N
|
N

A

A

G

G

I

V

S

H

H

V

V

A

G

G

N

S

L

V

E

L

N

E

T

T

A

S

E

I

E

D

D

D

F

W

D

R

R

R

L

I

Y

A

Q

G

V

V

N

D

V

I

K

D

G

G

I

V

Y

V

N

F

C

C

S

S

L

K

A

F

S

A

L

L

P

P

K

H

M

L

K

L

E

K

K

T

G

K

G

G

S

C

I

I

I

V

N

N

M

T

A

A

S
|
S

V
|
V

A
x
S

S

G

T

L

M

G

G

G

L

D

P

W

D

G

R

A

F

A

A

Y

Y
|
Y

S

C

M

A

T

A

K
|
K

G

G

A

A

V

V

F

V

S

N

M

L

T

T

L

R

S

A

M

M

A

A

R

L

D

D

Y

H

V

G

E

G

Y

D

N

G

I

V

R

R

V

I

N

N

S

S

I

V

A

C

P

P

G

S

R

L

V
|
V

H

K

T
|
T

P

N

F

M

V

T

D

N

G

G

F

-

L

-

A

-

K

-

N

-

Y

W

P

P

G

-

K

-

E

-

K

Q

E

E

M

I

F
x
R

D
|
D

K
|
K

L

F

A

N

A

E

T

R

Q

I

P

A

I

L

G

G

R

R

M

A

G

A

K

E

P

P

E

E

I

V

A

A

M

V

A

M

V

A

Y

F

L

L

S

A

S

S

D

D

E

D

A

A

S

S

F

F

L

I

T

N

G

G

G

A

N

N

Y

I

P

P

I

V

D

D

G

G

N15 (≠ S13) binding
M17 (≠ I15) binding
D36 (= D34) binding
D60 (= D60) binding
V61 (= V61) binding
N87 (= N84) binding
S138 (= S135) binding ; binding
V139 (= V136) mutation to Q: Retains 50% of activity with acetoin as substrate; when associated with A-247.
S140 (≠ A137) binding
Y151 (= Y148) binding ; binding ; binding
K155 (= K152) binding
V184 (= V181) binding
T186 (= T183) binding
RDK 197:199 (≠ FDK 202:204) mutation to SEAAGKPLGYGTET: Mimics longer alpha6 helix. Retains 3% of activity with acetoin as substrate.

Sites not aligning to the query:

247 Q→A: Retains 10% of activity with acetoin as substrate. Retains 50% of activity with acetoin as substrate; when associated with Q-139.

6vspA Structure of serratia marcescens 2,3-butanediol dehydrogenase mutant q247a (see paper)
37% identity, 97% coverage: 3:245/251 of query aligns to 5:240/251 of 6vspA

query
sites
6vspA

N

N

K

K

T

V

I

V

L

V

I

I

T

T

G
|
G

G

A

A

G

S
x
N

G
|
G

I
x
M

G

G

L

E

A

A

M

A

T

A

K

R

R

R

F

F

A

S

E

A

E

E

G

G

G

A

N

I

V

V

Y

V

F

L

I

A

D
|
D

Y
x
W

D
x
A

Q

K

K

E

T

A

G

V

E

D

K

K

V

V

A

A

E

A

E

S

L

L

T

-

S

P

K

K

G

G

H

-

R

R

V

A

T

M

F

A

L

V

Q

H

G
x
I

D
|
D

V
|
V

S

S

Q

D

-

H

-

V

-

A

T

V

E

E

E

K

M

M

K

M

Q

N

T

E

I

V

S

A

S

E

I

K

S

L

G

G

S

R

I

I

D

D

V

V

L

L

V

L

N

N

N
|
N

A
|
A

G
|
G

I
x
V

S

H

H

V

V

A

G

G

N

S

L

V

E

L

N

E

T

T

A

S

E

I

E

D

D

D

F

W

D

R

R

R

L

I

Y

A

Q

G

V
|
V

N

D

V

I

K

D

G

G

I

V

Y

V

N

F

C

C

S

S

L

K

A

F

S

A

L

L

P

P

K

H

M

L

K

L

E

K

K

T

G

K

G

G

S

C

I

I

I

V

N

N

M
x
T

A

A

S
|
S

V

V

A

S

S

G

T

L

M

G

G

G

L

D

P

W

D

G

R

A

F

A

A

Y

Y
|
Y

S

C

M

A

T

A

K
|
K

G

G

A

A

V

V

F

V

S

N

M

L

T

T

L

R

S

A

M

M

A

A

R

L

D

D

Y

H

V

G

E

G

Y

D

N

G

I

V

R

R

V

I

N

N

S

S

I

V

A

C

P
|
P

G
x
S

R
x
L

V
|
V

H

K

T
|
T

P
x
N

F
x
M

V
x
T

D

N

G

G

F

-

L

-

A

-

K

-

N

-

Y

W

P

P

G

-

K

-

E

-

K

Q

E

E

M

I

F

R

D

D

K

K

L

F

A

N

A

E

T

R

Q

I

P

A

I

L

G

G

R

R

M

A

G

A

K

E

P

P

E

E

I

V

A

A

M

V

A

M

V

A

Y

F

L

L

S

A

S

S

D

D

E

D

A

A

S

S

F

F

L

I

T

N

G

G

G

A

N

N

Y

I

P

P

I

V

D

D

G

G

active site: G16 (= G14), S138 (= S135), Y151 (= Y148)
binding nicotinamide-adenine-dinucleotide: G12 (= G10), N15 (≠ S13), G16 (= G14), M17 (≠ I15), D36 (= D34), W37 (≠ Y35), W37 (≠ Y35), A38 (≠ D36), I59 (≠ G59), D60 (= D60), V61 (= V61), N87 (= N84), A88 (= A85), G89 (= G86), V90 (≠ I87), V110 (= V107), T136 (≠ M133), S138 (= S135), Y151 (= Y148), K155 (= K152), P181 (= P178), S182 (≠ G179), L183 (≠ R180), V184 (= V181), T186 (= T183), N187 (≠ P184), M188 (≠ F185), T189 (≠ V186)

6vspB Structure of serratia marcescens 2,3-butanediol dehydrogenase mutant q247a (see paper)
37% identity, 97% coverage: 3:245/251 of query aligns to 7:242/252 of 6vspB

query
sites
6vspB

N

N

K

K

T

V

I

V

L

V

I

I

T

T

G
|
G

G

A

A

G

S
x
N

G
|
G

I

M

G

G

L

E

A

A

M

A

T

A

K

R

R

R

F

F

A

S

E

A

E

E

G

G

G

A

N

I

V

V

Y

V

F

L

I

A

D
|
D

Y
x
W

D

A

Q

K

K

E

T

A

G

V

E

D

K

K

V

V

A

A

E

A

E

S

L

L

T

-

S

P

K

K

G

G

H

-

R

R

V

A

T

M

F

A

L

V

Q

H

G
x
I

D
|
D

V
|
V

S

S

Q

D

-

H

-

V

-

A

T

V

E

E

E

K

M

M

K

M

Q

N

T

E

I

V

S

A

S

E

I

K

S

L

G

G

S

R

I

I

D

D

V

V

L

L

V

L

N

N

A

A

G
|
G

I

V

S

H

H

V

V

A

G

G

N

S

L

V

E

L

N

E

T

T

A

S

E

I

E

D

D

D

F

W

D

R

R

R

L

I

Y

A

Q

G

V

V

N

D

V

I

K

D

G

G

I

V

Y

V

N

F

C

C

S

S

L

K

A

F

S

A

L

L

P

P

K

H

M

L

K

L

E

K

K

T

G

K

G

G

S

C

I

I

I

V

N

N

M

T

A

A

S
|
S

V

V

A

S

S

G

T

L

M

G

G

G

L

D

P

W

D

G

R

A

F

A

A

Y

Y
|
Y

S

C

M

A

T

A

K

K

G

G

A

A

V

V

F

V

S

N

M

L

T

T

L

R

S

A

M

M

A

A

R

L

D

D

Y

H

V

G

E

G

Y

D

N

G

I

V

R

R

V

I

N

N

S

S

I

V

A

C

P

P

G

S

R

L

V

V

H

K

T

T

P

N

F

M

V

T

D

N

G

G

F

-

L

-

A

-

K

-

N

-

Y

W

P

P

G

-

K

-

E

-

K

Q

E

E

M

I

F

R

D

D

K

K

L

F

A

N

A

E

T

R

Q

I

P

A

I

L

G

G

R

R

M

A

G

A

K

E

P

P

E

E

I

V

A

A

M

V

A

M

V

A

Y

F

L

L

S

A

S

S

D

D

E

D

A

A

S

S

F

F

L

I

T

N

G

G

G

A

N

N

Y

I

P

P

I

V

D

D

G

G

active site: G18 (= G14), S140 (= S135), Y153 (= Y148)
binding adenosine-5'-diphosphate: G14 (= G10), N17 (≠ S13), D38 (= D34), W39 (≠ Y35), I61 (≠ G59), D62 (= D60), V63 (= V61), G91 (= G86)

7ejiB Crystal structure of kred f147l/l153q/y190p/l199a/m205f/m206f variant and methyl methacrylate complex
37% identity, 98% coverage: 1:246/251 of query aligns to 4:248/251 of 7ejiB

query
sites
7ejiB

M

L

K

K

N

G

K

K

T

V

I

A

L

I

I

V

T

T

G
|
G

G

G

A
x
T

S
x
L

G
|
G

I
|
I

G

G

L

L

A

A

M

I

T

A

K

D

R

K

F

F

A

V

E

E

G

G

G

A

N

K

V

V

Y

V

F

I

I

T

D

G

Y
x
R

D
x
H

Q

A

K

D

T

V

G

G

E

E

K

K

V

A

A

A

E

K

E

S

L

I

T

G

S

G

K

T

G

-

H

D

R

V

V

I

T

R

F

F

L

V

Q

Q

G

H

D
|
D

V
x
A

S

S

Q

D

-

E

-

A

-

G

T

W

E

T

E

K

M

L

K

F

Q

D

T

T

I

T

S

E

I

A

S

F

G

G

S

P

I

V

D

T

V

T

L

V

V

V

N

N

N
|
N

A
|
A

G

G

I

I

S

A

H

V

V

S

G

K

N

S

L

V

E

E

N

D

T

T

A

T

E

T

E

E

D

E

F

W

D

R

R

K

L

L

Y

L

Q

S

V
|
V

N

N

V

L

K

D

G

G

I

V

Y

F

N

F

C

G

S

T

L

R

A

L

S

G

L

I

P

Q

K

R

M

M

K

K

E

N

K

K

G

G

-

L

-

G

G

A

S

S

I

I

N

N

M
|
M

A

S

S
|
S

V
x
I

A

E

S

G

T

L

M

V

G

G

L

D

P

P

D

T

R

Q

F

G

A

A

Y
|
Y

S

N

M

A

T

S

K
|
K

G

G

A

A

V

V

F

R

S

I

M

M

T

S

L

K

S

S

M

A

A

A

R

L

D

D

Y

C

V

A

-

L

-

K

E

D

Y

Y

N

D

I

V

R

R

V

V

N

N

S

T

I

V

A

H

P
|
P

G

G

R
x
P

V
x
I

H

K

T
|
T

P
|
P

F
x
L

V

V

D

D

G

-

F

-

L

-

A

-

K

-

N

D

Y

A

P

E

G

G

K

A

E

E

K

-

E

E

M

F

F
|
F

D

S

K

Q

L

R

A

T

A

K

T

T

Q

-

P

P

I

M

G

G

R

H

M

I

G

G

K

E

P

P

E

N

E

D

I

I

A

A

A

W

M

I

A

C

V

V

Y

Y

L

L

S

A

S

S

D

D

E

E

A

S

S

K

F

F

L

A

T

T

G

G

G

A

N

E

Y

F

P

V

I

V

D

D

G

G

F

Y

binding methyl 2-methylprop-2-enoate: S142 (= S135), I143 (≠ V136), Y155 (= Y148), F205 (= F202)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G13 (= G10), T15 (≠ A12), L16 (≠ S13), G17 (= G14), I18 (= I15), R38 (≠ Y35), H39 (≠ D36), D62 (= D60), A63 (≠ V61), N89 (= N84), A90 (= A85), V112 (= V107), M140 (= M133), S142 (= S135), Y155 (= Y148), K159 (= K152), P187 (= P178), P189 (≠ R180), I190 (≠ V181), T192 (= T183), P193 (= P184), L194 (≠ F185)

7ejhA Crystal structure of kred mutant-f147l/l153q/y190p/l199a/m205f/m206f and 2-hydroxyisoindoline-1,3-dione complex
37% identity, 98% coverage: 1:246/251 of query aligns to 6:250/253 of 7ejhA

query
sites
7ejhA

M

L

K

K

N

G

K

K

T

V

I

A

L

I

I

V

T

T

G
|
G

G

G

A
x
T

S

L

G

G

I
|
I

G

G

L

L

A

A

M

I

T

A

K

D

R

K

F

F

A

V

E

E

G

G

G

A

N

K

V

V

Y

V

F

I

I

T

D

G

Y
x
R

D
x
H

Q

A

K

D

T

V

G

G

E

E

K

K

V

A

A

A

E

K

E

S

L

I

T

G

S

G

K

T

G

-

H

D

R

V

V

I

T

R

F

F

L

V

Q

Q

G

H

D
|
D

V
x
A

S

S

Q

D

-

E

-

A

-

G

T

W

E

T

E

K

M

L

K

F

Q

D

T

T

I

T

S

E

I

A

S

F

G

G

S

P

I

V

D

T

V

T

L

V

V

V

N

N

N
|
N

A
|
A

G

G

I

I

S

A

H

V

V

S

G

K

N

S

L

V

E

E

N

D

T

T

A

T

E

T

E

E

D

E

F

W

D

R

R

K

L

L

Y

L

Q

S

V
|
V

N

N

V

L

K

D

G

G

I

V

Y

F

N

F

C

G

S

T

L

R

A

L

S

G

L

I

P

Q

K

R

M

M

K

K

E

N

K

K

G

G

-

L

-

G

G

A

S

S

I

I

N

N

M
|
M

A

S

S
|
S

V
x
I

A
x
E

S

G

T

L

M

V

G

G

L

D

P

P

D

T

R

Q

F

G

A

A

Y
|
Y

S

N

M

A

T

S

K
|
K

G

G

A

A

V

V

F

R

S

I

M

M

T

S

L

K

S

S

M

A

A

A

R

L

D

D

Y

C

V

A

-

L

-

K

E

D

Y

Y

N

D

I

V

R

R

V

V

N

N

S

T

I

V

A

H

P
|
P

G
|
G

R
x
P

V
x
I

H

K

T
|
T

P
|
P

F
x
L

V
|
V

D

D

G

-

F

-

L

-

A

-

K

-

N

D

Y

A

P

E

G

G

K

A

E

E

K

-

E

E

M

F

F
|
F

D

S

K

Q

L

R

A

T

A

K

T

T

Q

-

P

P

I

M

G

G

R

H

M

I

G

G

K

E

P

P

E

N

E

D

I

I

A

A

A

W

M

I

A

C

V

V

Y

Y

L

L

S

A

S

S

D

D

E

E

A

S

S

K

F

F

L

A

T

T

G

G

G

A

N

E

Y

F

P

V

I

V

D

D

G

G

F

Y

binding 2-oxidanylisoindole-1,3-dione: S144 (= S135), I145 (≠ V136), E146 (≠ A137), Y157 (= Y148), V197 (= V186), F207 (= F202)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G15 (= G10), T17 (≠ A12), I20 (= I15), R40 (≠ Y35), H41 (≠ D36), D64 (= D60), A65 (≠ V61), N91 (= N84), A92 (= A85), V114 (= V107), M142 (= M133), S144 (= S135), Y157 (= Y148), K161 (= K152), P189 (= P178), G190 (= G179), P191 (≠ R180), I192 (≠ V181), T194 (= T183), P195 (= P184), L196 (≠ F185)

4wecA Crystal structure of a short chain dehydrogenase from mycobacterium smegmatis
38% identity, 98% coverage: 1:246/251 of query aligns to 8:250/258 of 4wecA

query
sites
4wecA

M

L

K

A

N

G

K

K

T

V

I

A

L

V

I

I

T

T

G
|
G

G

G

A
|
A

S
|
S

G
|
G

I
|
I

G

G

L

L

A

A

M

T

T

G

K

R

R

R

F

L

A

R

E

A

E

E

G

G

G

A

N

T

V

V

Y

V

F

V

I

G

D
|
D

Y
x
I

D

D

Q

P

K

T

T

T

G

G

E

K

K

A

V

A

A

A

E

D

E

E

L

L

T

E

S

G

K

-

G

-

H

-

R

-

V

-

T

L

F

F

L

V

Q

P

G
x
V

D
|
D

V
|
V

S

S

Q

E

T

Q

E

E

E

A

M

V

K

D

-

N

-

L

-

F

Q

D

T

T

I

A

S

A

S

S

I

T

S

F

G

G

S

R

I

V

D

D

V

I

L

A

V

F

N

N

N
|
N

A

A

G

G

I

I

S

S

H

P

V

P

G

E

N

D

-

D

-

L

L

I

E

E

N

N

T

T

A

D

E

L

E

P

D

A

F

W

D

Q

R

R

L

V

Y

Q

Q

D

V

I

N

N

V

L

K

K

G

S

I

V

Y

Y

N

L

C

S

S

C

L

R

A

A

S

A

L

L

P

R

K

H

M

M

K

V

E

P

K

A

G

G

-

K

G

G

S

S

I

I

N

N

M
x
T

A

A

S
|
S

V

F

A

V

S

A

T

V

M

M

G

G

-

S

L

A

P

T

D

S

R
x
Q

F

I

A

S

Y
|
Y

S

T

M

A

T

S

K
|
K

G

G

A

G

V

V

F

L

S

A

M

M

T

S

L

R

S

E

M

L

A

G

R

V

D

Q

Y

Y

V

A

E

R

Y

Q

N

G

I

I

R

R

V

V

N

N

S

A

I

L

A

C

P
|
P

G

G

R
x
P

V
|
V

H

N

T

T

P

P

F

L

V

L

D

Q

G

E

F

L

L

F

A

A

K

K

N

D

Y

-

P

P

G

E

K

R

E

A

K

A

E

R

M

R

F

L

D

V

K

H

L

I

A

-

T

-

Q

-

P

P

I

L

G

G

R

R

M

F

G

A

K

E

P

P

E

E

I

L

A

A

M

A

A

V

V

A

Y

F

L

L

S

A

S

S

D

D

E

D

A

A

S

S

F

F

L

I

T

T

G

G

G

S

N

T

Y

F

P

L

I

V

D

D

G

G

F

I

active site: G21 (= G14), S143 (= S135), Q154 (≠ R145), Y157 (= Y148), K161 (= K152)
binding nicotinamide-adenine-dinucleotide: G17 (= G10), A19 (= A12), S20 (= S13), G21 (= G14), I22 (= I15), D41 (= D34), I42 (≠ Y35), V61 (≠ G59), D62 (= D60), V63 (= V61), N89 (= N84), T141 (≠ M133), Y157 (= Y148), K161 (= K152), P187 (= P178), P189 (≠ R180), V190 (= V181)

1zk1A Structure of r-specific alcohol dehydrogenase (mutant g37d) from lactobacillus brevis in complex with phenylethanol and NAD (see paper)
36% identity, 98% coverage: 1:246/251 of query aligns to 4:248/251 of 1zk1A

query
sites
1zk1A

M

L

K

D

N

G

K

K

T

V

I

A

L

I

I

I

T

T

G
|
G

G

G

A

T

S
x
L

G
|
G

I
|
I

G

G

L

L

A

A

M

I

T

A

K

T

R

K

F

F

A

V

E

E

G

G

G

A

N

K

V

V

Y

M

F

I

I

T

D
|
D

Y

R

D

H

Q

S

K

D

T

V

G

G

E

E

K

K

V

A

A

A

E

K

E

S

L

V

T

G

S

T

K

P

G

-

H

D

R

Q

V

I

T

Q

F

F

L

F

Q

Q

G
x
H

D
|
D

V
x
S

S

S

Q

D

T

E

E

D

E

G

M

W

K

T

Q

K

T

L

I

F

S

D

S

A

I

T

S

E

-

K

-

A

-

F

G

G

S

P

I

V

D

S

V

T

L

L

V

V

N

N

N
|
N

A
|
A

G

G

I
|
I

S
x
A

H

V

V
x
N

G

K

N

S

L

V

E

E

N

E

T

T

A

T

E

T

E

A

D

E

F

W

D

R

R

K

L

L

Y

L

Q

A

V

V

N

N

V

L

K

D

G

G

I

V

Y

F

N

F

C

G

S

T

L

R

A

L

S

G

L

I

P

Q

K

R

M

M

K

K

E

N

K

K

G

G

-

L

-

G

G

A

S

S

I

I

N

N

M
|
M

A

S

S
|
S

V

I

A

E

S

G

T

F

M

V

G

G

L

D

P

P

D

S

R

L

F

G

A

A

Y
|
Y

S

N

M

A

T

S

K
|
K

G

G

A

A

V

V

F

R

S

I

M

M

T

S

L

K

S

S

M

A

A

A

R

L

D

D

Y

C

V

A

-

L

-

K

E

D

Y

Y

N

D

I

V

R

R

V

V

N

N

S

T

I

V

A

H

P

P

G
|
G

R
x
Y

V
x
I

H

K

T

T

P

P

F
x
L

V

V

D

D

G

-

F

-

L

-

A

-

K

-

N

D

Y

L

P

P

G

G

K

A

E

E

K

E

E

A

M

M

F

S

D

Q

K

R

L

-

A

-

A

T

T

K

Q

T

P

P

I

M

G

G

R

H

M

I

G

G

K

E

P

P

E

N

E

D

I

I

A

A

A

Y

M

I

A

C

V

V

Y

Y

L

L

S

A

S

S

D

N

E

E

A

S

S

K

F

F

L

A

T

T

G

G

G

S

N

E

Y

F

P

V

I

V

D

D

G

G

F

Y

active site: G17 (= G14), S142 (= S135), Y155 (= Y148), K159 (= K152)
binding 1-phenylethanone: A93 (≠ S88), N95 (≠ V90), Y155 (= Y148), Y189 (≠ R180)
binding nicotinamide-adenine-dinucleotide: G13 (= G10), L16 (≠ S13), I18 (= I15), D37 (= D34), H61 (≠ G59), D62 (= D60), S63 (≠ V61), N89 (= N84), A90 (= A85), I92 (= I87), M140 (= M133), Y155 (= Y148), G188 (= G179), I190 (≠ V181), L194 (≠ F185)

1zjzA Structure of r-specific alcohol dehydrogenase (mutant g37d) from lactobacillus brevis in complex with phenylethanol and NAD (see paper)
36% identity, 98% coverage: 1:246/251 of query aligns to 4:248/251 of 1zjzA

query
sites
1zjzA

M

L

K

D

N

G

K

K

T

V

I

A

L

I

I

I

T

T

G
|
G

G

G

A

T

S
x
L

G
|
G

I
|
I

G

G

L

L

A

A

M

I

T

A

K

T

R

K

F

F

A

V

E

E

G

G

G

A

N

K

V

V

Y

M

F

I

I

T

D
|
D

Y

R

D

H

Q

S

K

D

T

V

G

G

E

E

K

K

V

A

A

A

E

K

E

S

L

V

T

G

S

T

K

P

G

-

H

D

R

Q

V

I

T

Q

F

F

L

F

Q

Q

G

H

D
|
D

V

S

S

S

Q

D

T

E

E

D

E

G

M

W

K

T

Q

K

T

L

I

F

S

D

S

A

I

T

S

E

-

K

-

A

-

F

G

G

S

P

I

V

D

S

V

T

L

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I
|
I

S
x
A

H

V

V
x
N

G

K

N

S

L

V

E

E

N

E

T

T

A

T

E

T

E

A

D

E

F

W

D

R

R

K

L

L

Y

L

Q

A

V

V

N

N

V

L

K

D

G

G

I

V

Y

F

N

F

C

G

S

T

L

R

A

L

S

G

L

I

P

Q

K

R

M

M

K

K

E

N

K

K

G

G

-

L

-

G

G

A

S

S

I

I

N

N

M

M

A

S

S
|
S

V

I

A

E

S

G

T

F

M

V

G

G

L

D

P

P

D

S

R
x
L

F

G

A

A

Y
|
Y

S

N

M

A

T

S

K
|
K

G

G

A

A

V

V

F

R

S

I

M

M

T

S

L

K

S

S

M

A

A

A

R

L

D

D

Y

C

V

A

-

L

-

K

E

D

Y

Y

N

D

I

V

R

R

V

V

N

N

S

T

I

V

A

H

P

P

G
|
G

R

Y

V
x
I

H

K

T

T

P

P

F
x
L

V

V

D

D

G

-

F

-

L

-

A

-

K

-

N

D

Y

L

P

P

G

G

K

A

E

E

K

E

E

A

M

M

F

S

D

Q

K

R

L

-

A

-

A

T

T

K

Q

T

P

P

I

M

G

G

R

H

M

I

G

G

K

E

P

P

E

N

E

D

I

I

A

A

A

Y

M

I

A

C

V

V

Y

Y

L

L

S

A

S

S

D

N

E

E

A

S

S

K

F

F

L

A

T

T

G

G

G

S

N

E

Y

F

P

V

I

V

D

D

G

G

F

Y

active site: G17 (= G14), S142 (= S135), Y155 (= Y148), K159 (= K152)
binding nicotinamide-adenine-dinucleotide: G13 (= G10), L16 (≠ S13), I18 (= I15), D37 (= D34), D62 (= D60), N89 (= N84), A90 (= A85), G91 (= G86), I92 (= I87), Y155 (= Y148), G188 (= G179), I190 (≠ V181), L194 (≠ F185)
binding (1r)-1-phenylethanol: A93 (≠ S88), N95 (≠ V90), L152 (≠ R145), Y155 (= Y148)

1zjyA Structure of r-specific alcohol dehydrogenase (mutant g37d) from lactobacillus brevis in complex with phenylethanol and nadh (see paper)
36% identity, 98% coverage: 1:246/251 of query aligns to 4:248/251 of 1zjyA

query
sites
1zjyA

M

L

K

D

N

G

K

K

T

V

I

A

L

I

I

I

T

T

G
|
G

G

G

A

T

S
x
L

G
|
G

I
|
I

G

G

L

L

A

A

M

I

T

A

K

T

R

K

F

F

A

V

E

E

G

G

G

A

N

K

V

V

Y

M

F

I

I

T

D
|
D

Y

R

D

H

Q

S

K

D

T

V

G

G

E

E

K

K

V

A

A

A

E

K

E

S

L

V

T

G

S

T

K

P

G

-

H

D

R

Q

V

I

T

Q

F

F

L

F

Q

Q

G

H

D
|
D

V

S

S

S

Q

D

T

E

E

D

E

G

M

W

K

T

Q

K

T

L

I

F

S

D

S

A

I

T

S

E

-

K

-

A

-

F

G

G

S

P

I

V

D

S

V

T

L

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I
|
I

S
x
A

H

V

V
x
N

G

K

N

S

L

V

E

E

N

E

T

T

A

T

E

T

E

A

D

E

F

W

D

R

R

K

L

L

Y

L

Q

A

V

V

N

N

V

L

K

D

G

G

I

V

Y

F

N

F

C

G

S

T

L

R

A

L

S

G

L

I

P

Q

K

R

M

M

K

K

E

N

K

K

G

G

-

L

-

G

G

A

S

S

I

I

N

N

M

M

A

S

S
|
S

V

I

A

E

S

G

T

F

M

V

G

G

L

D

P

P

D

S

R
x
L

F

G

A

A

Y
|
Y

S

N

M

A

T

S

K
|
K

G

G

A

A

V

V

F

R

S

I

M

M

T

S

L

K

S

S

M

A

A

A

R

L

D

D

Y

C

V

A

-

L

-

K

E

D

Y

Y

N

D

I

V

R

R

V

V

N

N

S

T

I

V

A

H

P

P

G
|
G

R
x
Y

V
x
I

H

K

T

T

P

P

F
x
L

V

V

D

D

G

-

F

-

L

-

A

-

K

-

N

D

Y

L

P

P

G

G

K

A

E

E

K

E

E

A

M

M

F

S

D

Q

K

R

L

-

A

-

A

T

T

K

Q

T

P

P

I

M

G

G

R

H

M

I

G

G

K

E

P

P

E

N

E

D

I

I

A

A

A

Y

M

I

A

C

V

V

Y

Y

L

L

S

A

S

S

D

N

E

E

A

S

S

K

F

F

L

A

T

T

G

G

G

S

N

E

Y

F

P

V

I

V

D

D

G

G

F

Y

active site: G17 (= G14), S142 (= S135), Y155 (= Y148), K159 (= K152)
binding 1,4-dihydronicotinamide adenine dinucleotide: G13 (= G10), L16 (≠ S13), G17 (= G14), I18 (= I15), D37 (= D34), D62 (= D60), N89 (= N84), A90 (= A85), G91 (= G86), I92 (= I87), Y155 (= Y148), G188 (= G179), I190 (≠ V181), L194 (≠ F185)
binding (1r)-1-phenylethanol: A93 (≠ S88), N95 (≠ V90), L152 (≠ R145), Y155 (= Y148), Y189 (≠ R180)

Q6WVP7 NADP-dependent (R)-specific alcohol dehydrogenase; (R)-specific ADH; Ketoreductase; KRED; EC 1.1.1.- from Lentilactobacillus kefiri (Lactobacillus kefiri) (see paper)
37% identity, 98% coverage: 1:246/251 of query aligns to 5:249/252 of Q6WVP7

query
sites
Q6WVP7

M

L

K

K

N

G

K

K

T

V

I

A

L

I

I

V

T

T

G

G

A
x
T

S
x
L

G
|
G

I
|
I

G

G

L

L

A

A

M

I

T

A

K

D

R

K

F

F

A

V

E

E

G

G

G

A

N

K

V

V

Y

V

F

I

I

T

D

G

Y
x
R

D
x
H

Q

A

K

D

T

V

G

G

E

E

K

K

V

A

A

A

E

K

E

S

L

I

T

G

S

G

K

T

G

-

H

D

R

V

V

I

T

R

F

F

L

V

Q

Q

G

H

D
|
D

V
x
A

S

S

Q

D

-

E

-

A

-

G

T

W

E

T

E

K

M

L

K

F

Q

D

T

T

I

T

S

E

I

A

S

F

G

G

S

P

I

V

D

T

V

T

L

V

V

V

N

N

N
|
N

A

A

G

G

I

I

S

A

H

V

V

S

G

K

N

S

L

V

E

E

N

D

T

T

A

T

E

T

E

E

D

E

F

W

D

R

R

K

L

L

Y

L

Q

S

V

V

N

N

V

L

K

D

G

G

I

V

Y

F

N

F

C

G

S

T

L

R

A

L

S

G

L

I

P

Q

K

R

M

M

K

K

E

N

K

K

G

G

-

L

-

G

G

A

S

S

I

I

N

N

M

M

A

S

S

S

V

I

A

E

S

G

T

F

M

V

G

G

L

D

P

P

D

T

R

L

F

G

A

A

Y
|
Y

S

N

M

A

T

S

K
|
K

G

G

A

A

V

V

F

R

S

I

M

M

T

S

L

K

S

S

M

A

A

A

R

L

D

D

Y

C

V

A

-

L

-

K

E

D

Y

Y

N

D

I

V

R

R

V

V

N

N

S

T

I

V

A

H

P

P

G

G

R

Y

V
x
I

H
x
K

T
|
T

P
|
P

F
x
L

V

V

D

D

G

-

F

-

L

-

A

-

K

-

N

D

Y

L

P

E

G

G

K

A

E

E

K

-

E

E

M

M

F

M

D

S

K

Q

L

R

A

T

A

K

T

T

Q

-

P

P

I

M

G

G

R

H

M

I

G

G

K

E

P

P

E

N

E

D

I

I

A

A

A

W

M

I

A

C

V

V

Y

Y

L

L

S

A

S

S

D

D

E

E

A

S

S

K

F

F

L

A

T

T

G

G

G

A

N

E

Y

F

P

V

I

V

D

D

G

G

F

Y

TLGI 16:19 (≠ ASGI 12:15) binding
RH 39:40 (≠ YD 35:36) binding
DA 63:64 (≠ DV 60:61) binding
N90 (= N84) binding
Y156 (= Y148) binding
K160 (= K152) binding
IKTPL 191:195 (≠ VHTPF 181:185) binding

Sites not aligning to the query:

252 binding

1zk4A Structure of r-specific alcohol dehydrogenase (wildtype) from lactobacillus brevis in complex with acetophenone and NADP (see paper)
36% identity, 98% coverage: 1:246/251 of query aligns to 4:248/251 of 1zk4A

query
sites
1zk4A

M

L

K

D

N

G

K

K

T

V

I

A

L

I

I

I

T

T

G
|
G

G

G

A
x
T

S
x
L

G
|
G

I
|
I

G

G

L

L

A

A

M

I

T

A

K

T

R

K

F

F

A

V

E

E

G

G

G

A

N

K

V

V

Y

M

F

I

I
x
T

D
x
G

Y
x
R

D

H

Q

S

K

D

T

V

G

G

E

E

K

K

V

A

A

A

E

K

E

S

L

V

T

G

S

T

K

P

G

-

H

D

R

Q

V

I

T

Q

F

F

L

F

Q

Q

G
x
H

D
|
D

V

S

S

S

Q

D

T

E

E

D

E

G

M

W

K

T

Q

K

T

L

I

F

S

D

S

A

I

T

S

E

-

K

-

A

-

F

G

G

S

P

I

V

D

S

V

T

L

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I
|
I

S
x
A

H

V

V

N

G

K

N

S

L

V

E

E

N

E

T

T

A

T

E

T

E

A

D

E

F

W

D

R

R

K

L

L

Y

L

Q

A

V

V

N

N

V

L

K

D

G

G

I

V

Y

F

N

F

C

G

S

T

L

R

A

L

S

G

L

I

P

Q

K

R

M

M

K

K

E

N

K

K

G

G

-

L

-

G

G

A

S

S

I

I

N

N

M

M

A

S

S
|
S

V

I

A

E

S

G

T

F

M

V

G

G

L

D

P

P

D

S

R

L

F

G

A

A

Y
|
Y

S

N

M

A

T

S

K
|
K

G

G

A

A

V

V

F

R

S

I

M

M

T

S

L

K

S

S

M

A

A

A

R

L

D

D

Y

C

V

A

-

L

-

K

E

D

Y

Y

N

D

I

V

R

R

V

V

N

N

S

T

I

V

A

H

P

P

G
|
G

R
x
Y

V
x
I

H

K

T
|
T

P

P

F
x
L

V

V

D

D

G

-

F

-

L

-

A

-

K

-

N

D

Y

L

P

P

G

G

K

A

E

E

K

E

E

A

M

M

F

S

D

Q

K

R

L

-

A

-

A

T

T

K

Q

T

P

P

I

M

G

G

R

H

M

I

G

G

K

E

P

P

E

N

E

D

I

I

A

A

A

Y

M

I

A

C

V

V

Y

Y

L

L

S

A

S

S

D

N

E

E

A

S

S

K

F

F

L

A

T

T

G

G

G

S

N

E

Y

F

P

V

I

V

D

D

G

G

F

Y

active site: G17 (= G14), S142 (= S135), Y155 (= Y148), K159 (= K152)
binding 1-phenylethanone: A93 (≠ S88), Y155 (= Y148), Y189 (≠ R180)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G13 (= G10), T15 (≠ A12), L16 (≠ S13), I18 (= I15), T36 (≠ I33), G37 (≠ D34), R38 (≠ Y35), H61 (≠ G59), D62 (= D60), N89 (= N84), A90 (= A85), G91 (= G86), I92 (= I87), Y155 (= Y148), G188 (= G179), I190 (≠ V181), T192 (= T183), L194 (≠ F185)

6y0sAAA R-specific alcohol dehydrogenase (see paper)
36% identity, 98% coverage: 1:246/251 of query aligns to 4:248/251 of 6y0sAAA

query
sites
6y0sAAA

M

L

K

D

N

G

K

K

T

V

I

A

L

I

I

I

T

T

G

G

A
x
T

S

L

G
|
G

I

I

G

G

L

L

A

A

M

I

T

A

K

T

R

K

F

F

A

V

E

E

G

G

G

A

N

K

V

V

Y

M

F

I

I

T

D
x
G

Y

R

D
x
H

Q

S

K

D

T
x
V

G

G

E

E

K

K

V

A

A

A

E

K

E

S

L

V

T

G

S

T

K

P

G

-

H

D

R

Q

V

I

T

Q

F

F

L

F

Q

Q

G

H

D

D

V

S

S

S

Q

D

T

E

E

D

E

G

M

W

K

T

Q

K

T

L

I

F

S

D

S

A

I

T

S

E

-

K

-

A

-

F

G

G

S

P

I

V

D

S

V

T

L

L

V

V

N

N

A

A

G

G

I

I

S

A

H

V

V

N

G

K

N

S

L

V

E

E

N

E

T

T

A

E

E

T

E

A

D

E

F

W

D

R

R

K

L

L

Y

L

Q

A

V

V

N

N

V

L

K

D

G

G

I

V

Y

F

N

F

C

G

S

T

L

R

A

L

S

G

L

I

P

Q

K

R

M

M

K

K

E

N

K

K

G

G

-

L

-
x
G

G
x
A

S

S

I

I

N

N

M

M

A

S

S
|
S

V

I

A

E

S

G

T

F

M

V

G

G

L

D

P

P

D

S

R

L

F

G

A

A

Y
|
Y

S

N

M

A

T

S

K

K

G

G

A

A

V

V

F

R

S

I

M

M

T

S

L

K

S

S

M

A

A

A

R

L

D

D

Y

C

V

A

-

L

-

K

E

D

Y

Y

N
x
D

I

V

R
|
R

V

V

N

N

S

T

I

V

A

H

P

P

G

G

R

Y

V

I

H

K

T

T

P

P

F

L

V

V

D

D

G

-

F

-

L

-

A

-

K

-

N

D

Y

L

P

P

G

G

K

A

E

E

K

E

E

A

M

M

F

S

D

Q

K

R

L

-

A

-

A

T

T

K

Q

T

P

P

I

M

G

G

R

H

M

I

G

G

K

E

P

P

E

N

E

D

I

I

A

A

A

Y

M

I

A

C

V

V

Y

Y

L

L

S

A

S

S

D

N

E

E

A

S

S

K

F

F

L

A

T

T

G

G

G

S

N

E

Y

F

P

V

I

V

D

D

G

G

F

Y

active site: G17 (= G14), S142 (= S135), Y155 (= Y148)
binding magnesium ion: T15 (≠ A12), G37 (≠ D34), H39 (≠ D36), V42 (≠ T39), G134 (vs. gap), A135 (≠ G128), D179 (≠ N170), R181 (= R172)

Q8JZV9 Dehydrogenase/reductase SDR family member 6; (R)-beta-hydroxybutyrate dehydrogenase; 3-hydroxybutyrate dehydrogenase type 2; 4-oxo-L-proline reductase; Oxidoreductase UCPA; Short chain dehydrogenase/reductase family 15C member 1; EC 1.1.1.-; EC 1.1.1.30; EC 1.1.1.104 from Mus musculus (Mouse) (see paper)
38% identity, 98% coverage: 1:246/251 of query aligns to 4:243/245 of Q8JZV9

query
sites
Q8JZV9

M

L

K

D

N

G

K

K

T

V

I

I

L

V

I

L

T

T

G

A

A

A

S

Q

G

G

I

I

G

G

L

R

A

A

M

S

T

A

K

L

R

A

F

F

A

A

E

R

E

E

G

G

G

A

N

K

V

V

Y

I

F

A

I

T

D

D

Y

I

D

N

Q

E

K

-

T

-

G

-

E

S

K

K

V

L

A

Q

E

E

E

L

L

E

T

S

S

Y

K

R

G

G

H

I

R

Q

V

T

T

R

F

V

L

L

Q

-

G

-

D

D

V

V

S

T

Q

K

T

K

E

R

E

Q

M

I

K

D

Q

Q

T

F

I

A

S

S

S

E

I

I

S

E

G

-

S

R

I

I

D

D

V

V

L

L

V

F

N

N

N

V

A

A

G

G

I

F

S

V

H

H

V

H

G

G

N

T

L

I

E

L

N

D

T

C

A

E

E

E

E

K

D

D

F

W

D

D

R

F

L

S

Y

M

Q

N

V

L

N

N

V

V

K

R

G

S

I

M

Y

F

N

L

C

M

S

I

L

K

A

A

S

F

L

L

P

P

K

K

M

M

-

L

K

A

E

Q

K

K

G

S

G

G

S

N

I

I

N

N

M

M

A

S

S

S

V

V

A

A

S

S

T

S

M

I

-

K

G

G

L

V

P

E

D

N

R

R

F

C

A

V

Y
|
Y

S

S

M

A

T

T

K

K

G

A

A

A

V

V

F

I

S

G

M

L

T

T

L

K

S

S

M

V

A

A

R

A

D

D

Y

F

V

I

E

Q

Y

Q

N

G

I

I

R

R

V

C

N

N

S

C

I

V

A

C

P

P

G

G

R

T

V

V

H

D

T

T

P

P

-

S

F

L

V

Q

D

E

G

R

F

I

L

Q

A

A

K

R

N

D

Y

N

P

P

G

-

K

-

E

-

K

K

E

E

M

A

F

L

D

K

K

T

L

F

A

L

A

N

T

R

Q

Q

P

K

I

T

G

G

R

R

M

F

G

A

K

S

P

A

E

E

I

V

A

A

A

L

M

L

A

C

V

V

Y

Y

L

L

S

A

S

S

D

D

E

E

A

S

S

A

F

Y

L

V

T

T

G

G

G

N

N

P

Y

V

P

I

I

I

D

D

G

G

F

W

Y147 (= Y148) active site, Proton acceptor; mutation to F: Loss of function.

D4A1J4 Dehydrogenase/reductase SDR family member 6; (R)-beta-hydroxybutyrate dehydrogenase; 3-hydroxybutyrate dehydrogenase type 2; 4-oxo-L-proline reductase; Oxidoreductase UCPA; Short chain dehydrogenase/reductase family 15C member 1; EC 1.1.1.-; EC 1.1.1.30; EC 1.1.1.104 from Rattus norvegicus (Rat) (see paper)
38% identity, 98% coverage: 1:246/251 of query aligns to 4:243/245 of D4A1J4

query
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D4A1J4

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Y147 (= Y148) mutation to F: Loss of function.

7pcsB Structure of the heterotetrameric sdr family member bbscd (see paper)
36% identity, 98% coverage: 1:245/251 of query aligns to 2:241/247 of 7pcsB

query
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7pcsB

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binding nicotinamide-adenine-dinucleotide: G11 (= G10), M16 (≠ I15), D35 (= D34), I36 (≠ Y35), I62 (≠ V61), N88 (= N84), G90 (= G86), I138 (≠ M133), S140 (= S135), Y152 (= Y148), K156 (= K152), I185 (≠ V181)

Query Sequence

>Echvi_2940 Echvi_2940 Dehydrogenases with different specificities (related to short-chain alcohol dehydrogenases)
MKNKTILITGGASGIGLAMTKRFAEEGGNVYFIDYDQKTGEKVAEELTSKGHRVTFLQGD
VSQTEEMKQTISSISGSIDVLVNNAGISHVGNLENTAEEDFDRLYQVNVKGIYNCSLASL
PKMKEKGGSIINMASVASTMGLPDRFAYSMTKGAVFSMTLSMARDYVEYNIRVNSIAPGR
VHTPFVDGFLAKNYPGKEKEMFDKLAATQPIGRMGKPEEIAAMAVYLSSDEASFLTGGNY
PIDGGFVNLKM

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