SitesBLAST

Q9X5C9 Quinate/shikimate dehydrogenase (NAD(+)); QSDH; EC 1.1.1.-; EC 1.1.1.24 from Corynebacterium glutamicum (strain ATCC 13032 / DSM 20300 / BCRC 11384 / JCM 1318 / LMG 3730 / NCIMB 10025) (see paper)
49% identity, 98% coverage: 5:283/285 of query aligns to 2:283/283 of Q9X5C9

query
sites
Q9X5C9

N

N

I

D

T

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V

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L

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A

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G

G

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I

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G

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Q

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N

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L

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D

-

A

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H

N

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x
V

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N

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Y

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D

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H

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-

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A

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V

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N

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M

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N

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L

S17 (= S20) binding
SRT 17:19 (= SRT 20:22) binding
T69 (= T72) binding ; binding
K73 (= K76) active site, Proton acceptor; binding ; binding
N94 (= N97) binding ; binding
D110 (= D112) binding ; binding
GV 137:138 (≠ GA 139:140) binding
D158 (= D160) binding
R163 (= R165) binding
PMGM 203:206 (= PMGM 203:206) binding
A213 (≠ P213) binding
V228 (≠ I228) binding
G251 (= G251) binding
Q258 (= Q258) binding ; binding

Q58484 Shikimate dehydrogenase (NADP(+)); SDH; EC 1.1.1.25 from Methanocaldococcus jannaschii (strain ATCC 43067 / DSM 2661 / JAL-1 / JCM 10045 / NBRC 100440) (Methanococcus jannaschii) (see paper)
34% identity, 95% coverage: 7:276/285 of query aligns to 6:272/282 of Q58484

query
sites
Q58484

T

T

V

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L

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G

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GAGGA 130:134 (= GAGGA 136:140) binding
NRTVEK 152:157 (≠ DVEVSR 160:165) binding
T196 (= T202) binding
M200 (= M206) binding
L224 (≠ I228) binding

1nvtB Crystal structure of shikimate dehydrogenase (aroe or mj1084) in complex with NADP+ (see paper)
34% identity, 95% coverage: 7:276/285 of query aligns to 11:277/287 of 1nvtB

query
sites
1nvtB

T

T

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x
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M

active site: K75 (= K76), D111 (= D112)
binding nadp nicotinamide-adenine-dinucleotide phosphate: I72 (≠ F73), D111 (= D112), G135 (= G136), A136 (= A137), G137 (= G138), G138 (= G139), A139 (= A140), N157 (≠ D160), R158 (≠ V161), T159 (≠ E162), K162 (≠ R165), A200 (≠ T201), T201 (= T202), P202 (= P203), I203 (≠ M204), M205 (= M206), L229 (≠ I228), Y231 (= Y230), G252 (= G251), M255 (= M254), L256 (≠ A255)
binding zinc ion: E22 (≠ Q18), H23 (≠ A19)

1nvtA Crystal structure of shikimate dehydrogenase (aroe or mj1084) in complex with NADP+ (see paper)
34% identity, 95% coverage: 7:276/285 of query aligns to 11:277/287 of 1nvtA

query
sites
1nvtA

T

T

V

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A

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G

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L

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N

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x
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x
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x
L

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M

active site: K75 (= K76), D111 (= D112)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G135 (= G136), A136 (= A137), G137 (= G138), G138 (= G139), A139 (= A140), N157 (≠ D160), R158 (≠ V161), T159 (≠ E162), K162 (≠ R165), A200 (≠ T201), T201 (= T202), P202 (= P203), I203 (≠ M204), M205 (= M206), L229 (≠ I228), I230 (≠ V229), Y231 (= Y230), G252 (= G251), M255 (= M254), L256 (≠ A255)

Q5HNV1 Shikimate dehydrogenase (NADP(+)); SDH; EC 1.1.1.25 from Staphylococcus epidermidis (strain ATCC 35984 / RP62A) (see paper)
29% identity, 93% coverage: 12:276/285 of query aligns to 5:257/269 of Q5HNV1

query
sites
Q5HNV1

L

V

I

I

G

G

A

N

G

P

I

I

Q

S

A

H

S
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S

R
x
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x
S

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H

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E

H

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D

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A

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D

L

I

L

K

V

K

A

I

E

S

R

E

M

K

D

S

F

I

T

D

G

G

L

F

N

N

I

V

T
|
T

F

I

P

P

C

H

K

K

Q

E

A

R

I

I

P

P

L

Y

L

L

D

D

E

D

L

I

S

N

P

E

E

Q

A

A

R

K

G

S

I

V

G

G

A

A

V

V

N
|
N

T

T

V

V

V

L

L

V

K

K

D

D

G

G

K

K

R

W

I

I

G

G

H

Y

N

N

T

T

D
|
D

C

G

L

I

G

G

F

Y

A

V

E

N

G

G

F

L

R

K

R

Q

G

I

L

Y

G

E

D

G

V

I

A

E

R

D

Q

A

R

Y

V

I

V

L

Q

I

M

L

G

G

A

A

G

G

A

A

G

S

A

K

A

G

V

I

A

A

H

N

A

E

L

L

L

Y

L

K

E

I

D

V

V

R

E

P

T

T

L

L

S

T

I

V

F

A

D

N

V

R

E

T

V

M

S

S

R

R

A

F

E

N

A

N

L

W

V

S

N

L

N

N

L

I

N

N

Q

-

H

-

F

-

G

-

P

-

G

-

R

K

A

I

R

N

A

L

G

S

H

H

D

-

L

A

P

E

S

S

A

H

M

L

A

D

E

E

A

F

D

D

G

I

L

I

V

I

N

N

T

T

P

P

M

A

G

G

M

M

A

N

K

G

L

N

P

T

G

D

M

S

P

V

V

I

P

S

V

L

E

N

L

R

L

L

R

A

G

S

T

H

L

T

W

L

V

V

A

S

E

D

I

I

V

V

Y
|
Y

F

N

P

P

L

Y

E

K

T

T

E

P

L

I

L

L

R

I

N

E

A

A

R

E

A

Q

I

R

G

G

C

N

R

P

T

I

L

Y

D

N

G

G

G

L

N

D

M

M

A

F

V

V

F

H

Q
|
Q

A

G

V

A

K

E

A

S

F

F

E

K

L

I

F

W

S

T

G

N

V

L

A

E

P

P

D

D

A

I

Q

K

R

A

M

M

SLS 13:15 (≠ SRT 20:22) binding
T60 (= T72) binding
N85 (= N97) binding
D100 (= D112) binding
Y211 (= Y230) Plays a major role in the catalytic process and a minor role in the substrate binding; mutation to F: Leads to a 345-fold decrease in the catalytic efficiency and a 3-fold decrease in the affinity binding for shikimate.
Q239 (= Q258) binding

3tnlA 1.45 angstrom crystal structure of shikimate 5-dehydrogenase from listeria monocytogenes in complex with shikimate and NAD.
33% identity, 92% coverage: 7:267/285 of query aligns to 10:274/288 of 3tnlA

query
sites
3tnlA

T

T

V

E

L

L

A

I

G

G

L
|
L

I

I

G

A

A

T

G

P

I
|
I

Q

R

A

H

S
|
S

R

L

T
x
S

P

P

A

T

L

M

H

H

E

N

Q

E

E

A

G

F

D

A

A

K

Q

L

G

G

M

L

R

D

Y

Y

L

V

Y

Y

R

L

L

-

I

-

D

-

L

-

D

-

A

A

L

F

K

E

L

V

D

G

S

D

G

K

A

E

L

L

A

K

D

D

L

V

V

Q

A

G

A

F

E

R

R

A

M

M

D

N

F

L

T

R

G

G

L

W

N
|
N

I
x
V

T
x
S

F
x
M

P

P

C

N

K
|
K

Q

T

A

N

I

I

I

H

P

K

L

Y

L

L

D

D

E

K

L

L

S

S

P

P

E

A

A

A

R

E

G

L

I

V

G

G

A

A

V

V

N
|
N

T

T

V

V

L

N

K

D

D

D

G

G

K

V

R

L

I

T

G

G

H

H

N

I

T

T

D
|
D

C

G

L

T

G

G

F

Y

A

M

E

R

G

A

F

L

R

K

R

E

G

A

L

G

G

H

D

D

V

I

A

I

R

G

Q

K

R

K

V

M

V

T

Q

I

M

C

G
|
G

A
|
A

G
|
G

A
|
A

G

A

A

T

A

A

V

I

A

C

H

I

A

Q

L

A

L

L

E

D

D

G

V

V

E

K

T

E

L

I

S

S

I

I

F

F

D
x
N

V
x
R

E

K

-
x
D

-

D

-
x
F

V

Y

S

A

R

N

A

A

E

E

A

K

L

T

V

V

N

E

N

K

L

I

N

N

Q

S

H

K

F

-

G

T

P

D

G

C

R

K

A

A

R

Q

-

L

-

F

-

D

-

I

A

E

G

D

H

H

D

E

-

Q

L

L

P

R

S

K

A

E

M

I

A

A

E

E

A

S

D

V

G

I

L

F

V

T

N

N

T

A

T
|
T

P
x
G

M
x
V

G

G

M
|
M

A

K

K

P

L
x
F

P

E

G

G

M

E

P

T

V
x
L

-

L

-

P

P

S

V

A

E

D

L

M

L

L

R

R

G

P

T

E

L

L

W

I

V

V

A

S

E

D

I
x
V

V

V

Y
|
Y

F

K

P

P

L

T

E

K

T

T

E

R

L

L

R

E

N

I

A

A

R

E

A

E

I

Q

G

G

C

C

R

Q

T

T

L

L

D

N

G
|
G

G

L

N

G

M
|
M

A
x
M

V

L

F

W

Q
|
Q

A

G

V

A

K

K

A

A

F

F

E

E

L

I

F

W

S

T

binding nicotinamide-adenine-dinucleotide: M71 (≠ F73), D110 (= D112), G134 (= G136), A135 (= A137), G136 (= G138), G137 (= G139), A138 (= A140), N158 (≠ D160), R159 (≠ V161), D161 (vs. gap), F163 (vs. gap), T207 (= T202), G208 (≠ P203), V209 (≠ M204), M211 (= M206), F214 (≠ L209), L219 (≠ V214), V235 (≠ I228), Y237 (= Y230), G258 (= G251), M261 (= M254), M262 (≠ A255)
binding (3r,4s,5r)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid: L15 (= L12), I20 (= I17), S23 (= S20), S25 (≠ T22), N68 (= N70), V69 (≠ I71), S70 (≠ T72), K74 (= K76), N95 (= N97), D110 (= D112), M262 (≠ A255), Q265 (= Q258)

3tozA 2.2 angstrom crystal structure of shikimate 5-dehydrogenase from listeria monocytogenes in complex with NAD.
33% identity, 92% coverage: 7:267/285 of query aligns to 13:277/291 of 3tozA

query
sites
3tozA

T

T

V

E

L

L

A

I

G

G

L

L

I

I

G

A

A

T

G

P

I

I

Q

R

A

H

S

S

R

L

T

S

P

P

A

T

L

M

H

H

E

N

Q

E

E

A

G

F

D

A

A

K

Q

L

G

G

M

L

R

D

Y

Y

L

V

Y

Y

R

L

L

-

I

-

D

-

L

-

D

-

A

A

L

F

K

E

L

V

D

G

S

D

G

K

A

E

L

L

A

K

D

D

L

V

V

Q

A

G

A

F

E

R

R

A

M

M

D

N

F

L

T

R

G

G

L

W

N

N

I

V

T

S

F

M

P

P

C

N

K

K

Q

T

A

N

I

I

I

H

P

K

L

Y

L

L

D

D

E

K

L

L

S

S

P

P

E

A

A

A

R

E

G

L

I

V

G

G

A

A

V

V

N

N

T

T

V

V

L

N

K

D

D

D

G

G

K

V

R

L

I

T

G

G

H

H

N

I

T

T

D

D

C

G

L

T

G

G

F

Y

A

M

E

R

G

A

F

L

R

K

R

E

G

A

L

G

G

H

D

D

V

I

A

I

R

G

Q

K

R

K

V

M

V

T

Q

I

M

C

G
|
G

A
|
A

G
|
G

A
|
A

G

A

A

T

A

A

V

I

A

C

H

I

A

Q

L

A

L

L

E

D

D

G

V

V

E

K

T

E

L

I

S

S

I

I

F

F

D
x
N

V
x
R

E

K

-
x
D

-

D

-
x
F

V

Y

S

A

R

N

A

A

E

E

A

K

L

T

V

V

N

E

N

K

L

I

N

N

Q

S

H

K

F

-

G

T

P

D

G

C

R

K

A

A

R

Q

-

L

-

F

-

D

-

I

A

E

G

D

H

H

D

E

-

Q

L

L

P

R

S

K

A

E

M

I

A

A

E

E

A

S

D

V

G

I

L

F

V

T

N

N

T

A

T
|
T

P
x
G

M
x
V

G

G

M
|
M

A

K

K

P

L
x
F

P

E

G

G

M

E

P

T

V
x
L

-

L

-

P

P

S

V

A

E

D

L

M

L

L

R

R

G

P

T

E

L

L

W

I

V

V

A

S

E

D

I
x
V

V

V

Y
|
Y

F

K

P

P

L

T

E

K

T

T

E

R

L

L

R

E

N

I

A

A

R

E

A

E

I

Q

G

G

C

C

R

Q

T

T

L

L

D

N

G
|
G

G

L

N

G

M
|
M

A
x
M

V

L

F

W

Q
|
Q

A

G

V

A

K

K

A

A

F

F

E
|
E

L

I

F

W

S

T

binding nicotinamide-adenine-dinucleotide: G137 (= G136), A138 (= A137), G139 (= G138), G140 (= G139), A141 (= A140), N161 (≠ D160), R162 (≠ V161), D164 (vs. gap), F166 (vs. gap), T210 (= T202), G211 (≠ P203), V212 (≠ M204), M214 (= M206), F217 (≠ L209), L222 (≠ V214), V238 (≠ I228), Y240 (= Y230), G261 (= G251), M264 (= M254), M265 (≠ A255), Q268 (= Q258), E274 (= E264)

Sites not aligning to the query:

binding nicotinamide-adenine-dinucleotide: 278

Q8Y9N5 Shikimate dehydrogenase (NADP(+)); SDH; EC 1.1.1.25 from Listeria monocytogenes serovar 1/2a (strain ATCC BAA-679 / EGD-e)
33% identity, 92% coverage: 7:267/285 of query aligns to 13:277/291 of Q8Y9N5

query
sites
Q8Y9N5

T

T

V

E

L

L

A

I

G

G

L

L

I

I

G

A

A

T

G

P

I

I

Q

R

A

H

S
|
S

R
x
L

T
x
S

P

P

A

T

L

M

H

H

E

N

Q

E

E

A

G

F

D

A

A

K

Q

L

G

G

M

L

R

D

Y

Y

L

V

Y

Y

R

L

L

-

I

-

D

-

L

-

D

-

A

A

L

F

K

E

L

V

D

G

S

D

G

K

A

E

L

L

A

K

D

D

L

V

V

Q

A

G

A

F

E

R

R

A

M

M

D

N

F

L

T

R

G

G

L

W

N

N

I

V

T

S

F

M

P

P

C

N

K

K

Q

T

A

N

I

I

I

H

P

K

L

Y

L

L

D

D

E

K

L

L

S

S

P

P

E

A

A

A

R

E

G

L

I

V

G

G

A

A

V

V

N

N

T

T

V

V

L

N

K

D

D

D

G

G

K

V

R

L

I

T

G

G

H

H

N

I

T

T

D

D

C

G

L

T

G

G

F

Y

A

M

E

R

G

A

F

L

R

K

R

E

G

A

L

G

G

H

D

D

V

I

A

I

R

G

Q

K

R

K

V

M

V

T

Q

I

M

C

G

G

A

A

G

G

A

A

G

A

A

T

A

A

V

I

A

C

H

I

A

Q

L

A

L

L

E

D

D

G

V

V

E

K

T

E

L

I

S

S

I

I

F

F

D
x
N

V
x
R

E
x
K

-
x
D

-

D

-

F

V

Y

S

A

R

N

A

A

E

E

A

K

L

T

V

V

N

E

N

K

L

I

N

N

Q

S

H

K

F

-

G

T

P

D

G

C

R

K

A

A

R

Q

-

L

-

F

-

D

-

I

A

E

G

D

H

H

D

E

-

Q

L

L

P

R

S

K

A

E

M

I

A

A

E

E

A

S

D

V

G

I

L

F

V

T

N

N

T

A

T

T

P

G

M

V

G

G

M
|
M

A

K

K

P

L

F

P

E

G

G

M

E

P

T

V

L

-

L

-

P

P

S

V

A

E

D

L

M

L

L

R

R

G

P

T

E

L

L

W

I

V

V

A

S

E

D

I

V

V

V

Y

Y

F

K

P

P

L

T

E

K

T

T

E

R

L

L

R

E

N

I

A

A

R

E

A

E

I

Q

G

G

C

C

R

Q

T

T

L

L

D

N

G

G

G

L

N

G

M

M

A

M

V

L

F

W

Q

Q

A

G

V

A

K

K

A

A

F

F

E

E

L

I

F

W

S

T

SLS 26:28 (≠ SRT 20:22) binding
NRKD 161:164 (≠ DVE- 160:162) binding
M214 (= M206) binding

3dooA Crystal structure of shikimate dehydrogenase from staphylococcus epidermidis complexed with shikimate (see paper)
29% identity, 93% coverage: 12:276/285 of query aligns to 5:248/258 of 3dooA

query
sites
3dooA

L
x
V

I

I

G

G

A

N

G

P

I

I

Q

S

A

H

S
|
S

R

L

T
x
S

P

P

A

L

L

M

H

H

E

H

Q

A

E

N

G

F

D

Q

A

S

Q

L

G

N

M

L

R

E

Y

N

L

T

Y

Y

R

-

L

-

I

-

D

-

L

-

D

E

A

A

L

I

K

N

L

V

D

P

S

V

G

N

A

Q

L

F

A

Q

D

D

L

I

L

K

V

K

A

I

E

S

R

E

M

K

D

S

F

I

T

D

G

G

L

F

N
|
N

I
x
V

T
|
T

F

I

P

P

C

H

K
|
K

Q

E

A

R

I

I

P

P

L

Y

L

L

D

D

E

D

L

I

S

N

P

E

E

Q

A

A

R

K

G

S

I

V

G

G

A

A

V

V

N
|
N

T

T

V

V

V

L

L

V

K

K

D

D

G

G

K

K

R

W

I

I

G

G

H

Y

N

N

T

T

D
|
D

C

G

L

I

G

G

F

Y

A

V

E

N

G

G

F

L

R

K

R

Q

G

I

L

Y

G

E

D

G

V

I

A

E

R

D

Q

A

R

Y

V

I

V

L

Q

I

M

L

G

G

A

A

G

G

A

A

G

S

A

K

A

G

V

I

A

A

H

N

A

E

L

L

L

Y

L

K

E

I

D

V

V

R

E

P

T

T

L

L

S

T

I

V

F

A

D

N

V

R

E

T

V

M

S

S

R

R

A

F

E

N

A

N

L

W

V

S

N

L

N

N

L

I

N

N

Q

-

H

-

F

-

G

-

P

-

G

-

R

K

A

I

R

N

A

L

G

S

H

H

D

-

L

A

P

E

S

S

A

H

M

L

A

D

E

E

A

F

D

D

G

I

L

I

V

I

N

N

T

T

P

P

M

V

G

-

M

-

A

-

K

-

L

-

P

-

G

-

M

-

P

-

V

I

P

S

V

L

E

N

L

R

L

L

R

A

G

S

T

H

L

T

W

L

V

V

A

S

E

D

I

I

V

V

Y

Y

F

N

P

P

L

Y

E

K

T

T

E

P

L

I

L

L

R

I

N

E

A

A

R

E

A

Q

I

R

G

G

C

N

R

P

T

I

L

Y

D

N

G

G

G

L

N

D

M

M

A
x
F

V

V

F

H

Q
|
Q

A

G

V

A

K

E

A

S

F

F

E

K

L

I

F

W

S

T

G

N

V

L

A

E

P

P

D

D

A

I

Q

K

R

A

M

M

binding (3r,4s,5r)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid: V5 (≠ L12), S13 (= S20), S15 (≠ T22), N58 (= N70), V59 (≠ I71), T60 (= T72), K64 (= K76), N85 (= N97), D100 (= D112), F227 (≠ A255), Q230 (= Q258)

2hk9B Crystal structure of shikimate dehydrogenase from aquifex aeolicus in complex with shikimate and NADP+ at 2.2 angstrom resolution (see paper)
29% identity, 92% coverage: 7:268/285 of query aligns to 6:252/267 of 2hk9B

query
sites
2hk9B

T

T

V

Q

L

L

A

Y

G

G

L

V

I

I

G

G

A

F

G

P

I

V

Q

K

A

H

S
|
S

R

L

T
x
S

P

P

A

V

L

F

H

Q

E

N

Q

A

E

L

G

I

D

R

A

Y

Q

A

G

G

M

L

R

N

Y

A

L

V

Y

Y

R

L

L

-

I

-

D

-

L

-

D

-

A

A

L

F

K

E

L

I

D

N

S

P

G

E

A

E

L

L

A

K

D

K

L

A

L

F

V

E

A

G

A

F

E

K

R

A

M

L

D

K

F

V

T

K

G

G

L

I

N
|
N

I
x
V

T
|
T

F
x
V

P

P

C

F

K
|
K

Q

E

A

E

I

I

P

P

L

L

D

D

E

Y

L

V

S

E

P

D

E

T

A

A

R

K

G

E

I

I

G

G

A

A

V

V

N
|
N

T

T

V

V

V

K

L

F

K

E

D

N

G

G

K

K

R

A

I

Y

G

G

H

Y

N

N

T

T

D
|
D

C

W

L

I

G

G

F

F

A

L

E

K

G

S

F

L

R

K

R

S

G

L

L

I

G

P

D

E

V

V

A

K

R

E

Q

K

R

S

V

I

V

L

Q

V

M

L

G
|
G

A
|
A

G
|
G

A
|
A

G

S

A

R

A

A

V

V

A

I

H

Y

A

A

L

L

L

V

L

K

E

E

D

G

V

A

E

K

T

-

L

-

S

-

I

V

F

F

D

L

V

W

E
x
N

V
x
R

S
x
T

R

K

A

E

E
x
K

A

A

L

I

V

-

N

-

N

K

L

L

N

A

Q

Q

H

K

F

F

G

P

P

L

G

E

R

V

A

V

R

N

A

S

G

P

H

E

D

E

L

V

P

-

S

-

A

-

M

I

A

D

E

K

A

V

D

Q

G

V

L

I

V

V

N

N

T
|
T

P
x
S

M
x
V

G

G

M
x
L

A

K

K

D

L

E

P

D

G

P

M

E

P

I

V

F

P

N

V

Y

E

D

L

L

L

I

R

K

G

K

T

D

L

H

W

V

V

V

A

V

E

D

I
|
I

V

I

Y
|
Y

F

-

P

-

L

K

E

E

T

T

E

K

L

L

R

K

N

K

A

A

R

K

A

E

I

K

G

G

C

A

R

K

T

L

L

L

D

D

G
|
G

G

L

N

P

M
|
M

A
x
L

V

L

F

W

Q
|
Q

A

G

V

I

K

E

A

A

F

F

E

K

L

I

F

W

S

N

G

G

binding nadp nicotinamide-adenine-dinucleotide phosphate: V67 (≠ F73), K70 (= K76), D106 (= D112), G130 (= G136), A131 (= A137), G132 (= G138), G133 (= G139), A134 (= A140), N153 (≠ E162), R154 (≠ V163), T155 (≠ S164), K158 (≠ E167), T187 (= T201), T188 (= T202), S189 (≠ P203), V190 (≠ M204), L192 (≠ M206), I214 (= I228), G235 (= G251), M238 (= M254), L239 (≠ A255)
binding (3r,4s,5r)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid: S19 (= S20), S21 (≠ T22), N64 (= N70), V65 (≠ I71), T66 (= T72), K70 (= K76), N91 (= N97), D106 (= D112), Y216 (= Y230), L239 (≠ A255), Q242 (= Q258)

2hk9A Crystal structure of shikimate dehydrogenase from aquifex aeolicus in complex with shikimate and NADP+ at 2.2 angstrom resolution (see paper)
29% identity, 92% coverage: 7:268/285 of query aligns to 6:252/269 of 2hk9A

query
sites
2hk9A

T

T

V

Q

L

L

A

Y

G

G

L

V

I

I

G

G

A

F

G

P

I

V

Q

K

A

H

S
|
S

R

L

T
x
S

P

P

A

V

L

F

H

Q

E

N

Q

A

E

L

G

I

D

R

A

Y

Q

A

G

G

M

L

R

N

Y

A

L

V

Y

Y

R

L

L

-

I

-

D

-

L

-

D

-

A

A

L

F

K

E

L

I

D

N

S

P

G

E

A

E

L

L

A

K

D

K

L

A

L

F

V

E

A

G

A

F

E

K

R

A

M

L

D

K

F

V

T

K

G

G

L

I

N
|
N

I
x
V

T
|
T

F
x
V

P

P

C

F

K
|
K

Q

E

A

E

I

I

P

P

L

L

D

D

E

Y

L

V

S

E

P

D

E

T

A

A

R

K

G

E

I

I

G

G

A

A

V

V

N
|
N

T

T

V

V

V

K

L

F

K

E

D

N

G

G

K

K

R

A

I

Y

G

G

H

Y

N

N

T

T

D
|
D

C

W

L

I

G

G

F

F

A

L

E

K

G

S

F

L

R

K

R

S

G

L

L

I

G

P

D

E

V

V

A

K

R

E

Q

K

R

S

V

I

V

L

Q

V

M

L

G
|
G

A
|
A

G
|
G

A
|
A

G

S

A

R

A

A

V

V

A

I

H

Y

A

A

L

L

L

V

L

K

E

E

D

G

V

A

E

K

T

-

L

-

S

-

I

V

F

F

D

L

V

W

E
x
N

V
x
R

S
x
T

R

K

A

E

E
x
K

A

A

L

I

V

-

N

-

N

K

L

L

N

A

Q

Q

H

K

F

F

G

P

P

L

G

E

R

V

A

V

R

N

A

S

G

P

H

E

D

E

L

V

P

-

S

-

A

-

M

I

A

D

E

K

A

V

D

Q

G

V

L

I

V

V

N

N

T
|
T

P
x
S

M
x
V

G

G

M

L

A

K

K

D

L

E

P

D

G

P

M

E

P

I

V

F

P

N

V

Y

E

D

L

L

L

I

R

K

G

K

T

D

L

H

W

V

V

V

A

V

E

D

I

I

V

I

Y
|
Y

F

-

P

-

L

K

E

E

T

T

E

K

L

L

R

K

N

K

A

A

R

K

A

E

I

K

G

G

C

A

R

K

T

L

L

L

D

D

G

G

G

L

N

P

M

M

A
x
L

V

L

F

W

Q
|
Q

A

G

V

I

K

E

A

A

F

F

E

K

L

I

F

W

S

N

G

G

binding 2'-monophosphoadenosine-5'-diphosphate: V67 (≠ F73), G130 (= G136), A131 (= A137), G132 (= G138), G133 (= G139), A134 (= A140), N153 (≠ E162), R154 (≠ V163), T155 (≠ S164), K158 (≠ E167), T187 (= T201), T188 (= T202), S189 (≠ P203), V190 (≠ M204)
binding (3r,4s,5r)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid: S19 (= S20), S21 (≠ T22), N64 (= N70), V65 (≠ I71), T66 (= T72), K70 (= K76), N91 (= N97), D106 (= D112), Y216 (= Y230), L239 (≠ A255), Q242 (= Q258)

7colA Crystal structure of 5-ketofructose reductase complexed with NADPH (see paper)
36% identity, 86% coverage: 40:283/285 of query aligns to 36:277/280 of 7colA

query
sites
7colA

R

R

L

Y

I

I

D

N

L

C

D

D

A

-

L

-

K

-

L

V

D

K

S

A

G

S

A

G

L

L

A

A

D

D

L

A

L

V

V

K

A

G

A

A

E

K

R

A

M

M

D

E

F

W

T

V

G

G

L

F

N

N

I

C

T

S

F

L

P

P

C

H

K

K

Q

V

A

A

I

V

I

L

P

D

L

H

L

L

D

D

E

D

L

I

S

A

P

E

E

S

A

A

R

R

G

L

I

I

G

G

A

A

V

V

N

N

T

C

V

V

V

A

L

I

K

R

D

E

G

G

K

K

R

L

I

I

G

G

H

H

N

N

T

T

D
|
D

C

G

L

K

G

G

F

F

A

L

E

A

G

S

F

L

R

K

R

T

G

-

L

V

G

T

D

S

V

P

A

A

R

G

Q

K

R

R

V

V

Q

I

M

L

G
|
G

A
|
A

G
|
G

A
|
A

G

A

A

R

A

A

V

I

A

A

H

V

A

E

L

L

L

A

L

L

E

A

D

G

V

A

E

A

T

H

L

I

S

T

I

I

F

V

D
x
N

V
x
R

E
x
D

V

A

S

S

R
x
K

A

A

E

E

-

T

-

I

-

A

A

A

L

L

V

I

N

N

N

D

L

K

N

T

Q

E

H

A

F

T

G

G

P

E

G

A

R

Q

A

A

R
x
W

A

S

G

G

H

K

-

F

D

S

L

L

P

P

S

T

A

G

M

-

A

-

E

-

A

T

D

D

G

I

L

L

V

I

N

N

T
x
A

T
|
T

P
x
S

M
x
I

G

G

M
x
L

A

G

K

D

L

-

P

P

G

N

M

A

P

A

V

P

P

P

V

V

E

E

L

M

-

G

-

S

L

L

R

T

G

K

T

E

L

T

W

V

V

V

A

A

E

D

I
x
V

V

I

Y

P

F

N

P

P

L

P

E

Q

T

T

E

R

L

F

L

L

R

K

N

D

A

A

R

K

A

A

I

L

G

G

C

C

R

T

T

T

L

L

D

D

G
|
G

G

L

N

G

M
|
M

A
x
L

V

V

F

N

Q
|
Q

A

G

V

V

K

I

A

G

F

V

E

E

L

I

F

W

S

L

G

G

V

R

A

T

P

L

D

D

A

S

Q

A

R

V

M

M

L

A

E

Q

H

T

F

L

Q

E

S

N

M

I

binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: D105 (= D112), G128 (= G136), A129 (= A137), G130 (= G138), G131 (= G139), A132 (= A140), N152 (≠ D160), R153 (≠ V161), D154 (≠ E162), K157 (≠ R165), W178 (≠ R183), A194 (≠ T201), T195 (= T202), S196 (≠ P203), I197 (≠ M204), L199 (≠ M206), V222 (≠ I228), G245 (= G251), M248 (= M254), L249 (≠ A255), Q252 (= Q258)

O67049 Shikimate dehydrogenase (NADP(+)); SD; SDH; EC 1.1.1.25 from Aquifex aeolicus (strain VF5) (see paper)
29% identity, 92% coverage: 7:268/285 of query aligns to 6:252/269 of O67049

query
sites
O67049

T

T

V

Q

L

L

A

Y

G

G

L

V

I

I

G

G

A

F

G

P

I

V

Q

K

A

H

S
|
S

R
x
L

T
x
S

P

P

A

V

L

F

H

Q

E

N

Q

A