SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing WP_010960235.1 NCBI__GCF_000008325.1:WP_010960235.1 to proteins with known functional sites using BLASTp with E ≤ 0.001.

Or try Sites on a Tree, PaperBLAST, Conserved Domains, or compare to all protein structures

Found 20 (the maximum) hits to proteins with known functional sites (download)

4iiuA Crystal structure of a putative 3-oxoacyl-[acyl-carrier protein]reductase from escherichia coli strain cft073 complexed with NADP+ at 2.1 a resolution
48% identity, 100% coverage: 2:239/239 of query aligns to 3:243/243 of 4iiuA

query
sites
4iiuA

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active site: G13 (= G12), S140 (= S137), Y153 (= Y150), K157 (= K154)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G9 (= G8), S11 (= S10), K12 (≠ G11), G13 (= G12), I14 (= I13), H32 (= H31), H34 (= H33), D36 (≠ H35), D60 (= D59), V61 (= V60), N87 (= N85), A88 (= A86), G89 (= G87), I90 (= I88), S140 (= S137), Y153 (= Y150), K157 (= K154), P183 (= P180), G184 (= G181), I186 (= I183), T188 (= T185), M190 (vs. gap), I191 (vs. gap)

7caxD Crystal structure of bacterial reductase
47% identity, 100% coverage: 2:239/239 of query aligns to 2:238/238 of 7caxD

query
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7caxD

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active site: G12 (= G12), S139 (= S137), Y152 (= Y150)
binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G8 (= G8), S10 (= S10), R11 (≠ G11), I13 (= I13), H31 (= H31), R33 (≠ H33), S34 (≠ G34), R35 (≠ H35), D59 (= D59), V60 (= V60), N86 (= N85), A87 (= A86), G88 (= G87), S139 (= S137), Y152 (= Y150), K156 (= K154), P182 (= P180), G183 (= G181), I185 (= I183)

3osuA Crystal structure of the 3-oxoacyl-acyl carrier protein reductase, fabg, from staphylococcus aureus
45% identity, 99% coverage: 2:238/239 of query aligns to 5:244/246 of 3osuA

query
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3osuA

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active site: G15 (= G12), S141 (= S137), Q151 (= Q147), Y154 (= Y150), K158 (= K154)
binding magnesium ion: N89 (= N85), K158 (= K154)

3sj7A Structure of beta-ketoacetyl-coa reductase (fabg) from staphylococcus aureus complex with NADPH (see paper)
44% identity, 99% coverage: 2:238/239 of query aligns to 2:237/239 of 3sj7A

query
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3sj7A

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active site: G12 (= G12), S138 (= S137), Q148 (= Q147), Y151 (= Y150), K155 (= K154)
binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G8 (= G8), S10 (= S10), R11 (≠ G11), I13 (= I13), N31 (≠ H31), Y32 (= Y32), A33 (≠ H33), G34 (= G34), S35 (≠ H35), A58 (≠ F58), N59 (≠ D59), V60 (= V60), N86 (= N85), A87 (= A86), T109 (≠ V108), S138 (= S137), Y151 (= Y150), K155 (= K154), P181 (= P180), G182 (= G181)

P73574 3-oxoacyl-[acyl-carrier-protein] reductase; 3-ketoacyl-acyl carrier protein reductase; EC 1.1.1.100 from Synechocystis sp. (strain PCC 6803 / Kazusa) (see paper)
45% identity, 99% coverage: 4:239/239 of query aligns to 9:245/247 of P73574

query
sites
P73574

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P

P

M

L

K

A

R

R

A

Y

G

G

R

Q

P

P

E

E

V

V

A

A

D

G

L

T

V

I

A

R

F

F

L

L

A

A

S

T

D

D

-

P

R

A

A

A

Y

Y

I

I

T

T

G

G

Q

Q

V

T

I

F

S

N

I

V

N

D

G

G

I

M

I

V

A14 (≠ G9) mutation to G: 4.2-fold increase in activity on acetoacetyl-CoA.
P151 (≠ R145) mutation to F: 2.7-fold increase in activity on acetoacetyl-CoA.; mutation to V: 5.7-fold increase in activity on acetoacetyl-CoA.
K160 (= K154) mutation to A: Almost no activity on acetoacetyl-CoA.
F188 (≠ I182) mutation to Y: 3.3-fold increase in activity on acetoacetyl-CoA.
N198 (≠ D193) mutation to R: 3.5-fold increase in activity on acetoacetyl-CoA.

9clyB Crystal structure of the 3-ketoacyl-(acyl-carrier-protein) reductase, cylg, from streptococcus agalactiae 2603v/r
40% identity, 100% coverage: 1:239/239 of query aligns to 3:240/242 of 9clyB

query
sites
9clyB

M

M

R

K

Q

V

A

A

L

I

V

V

S

T

G
|
G

G

G

S

T

G
x
R

G
|
G

I
|
I

G

G

A

R

A

A

I

I

C

T

R

K

R

E

L

L

A

Y

L

K

D

E

G

G

L

Y

H

K

V

V

W

I

V

A

H

I

Y
|
Y

H
x
N

G
x
S

H

N

R

D

Q

A

S

K

A

A

E

R

Q

A

V

L

V

Q

D

E

A

E

I

L

R

P

V

-

G

-

S

K

A

L

E

D

A

V

I

Y

G

K

F
x
C

D
x
N

V
x
I

C

S

D

D

A

A

A

K

A

A

A

V

A

Q

A

K

A

L

I

V

A

T

T

K

M

I

C

F

A

R

E

E

R

Y

P

G

-

G

I

I

Q

D

V

C

L

L

V

V

N

N

N
|
N

A

A

G

G

I

I

H

V

D

R

D

D

A

G

V

F

F

F

P

L

A

M

M

M

R

S

S

K

D

E

Q

K

W

W

H

M

R

D

V

V

I

I

D

N

V

I

S

N

L

I

N

M

G

G

F

L

F

V

N

N

L

M

T

S

Q

K

P

A

L

V

V

L

M

K

P

I

M

M

I

K

R

A

E

K

R

R

-

I

W

Q

G

G

R

K

I

V

V

I

N

N

I
|
I

S

S

S
|
S

V

T

A

S

A

G

L

I

T

A

G

G

N

Q

R

I

G

G

Q

Q

V

A

N

N

Y
|
Y

S

S

A

A

A

T

K
|
K

G

G

A

A

L

I

H

I

S

S

A

I

T

T

R

K

S

T

L

L

A

A

L

K

E

E

L

F

A

A

S

S

R

D

G

G

V

I

T

T

V

I

N

N

A

C

V

V

A

S

P

P

G
|
G

I

F

I
|
I

E

E

T
|
T

G

D

M
|
M

A

T

E

N

S

E

A

L

F

Q

D

N

R

K

A

E

I

L

-

K

E

E

R

H

L

L

V

I

P

P

M

L

K

K

R

R

A

F

G

G

R

Q

P

P

E

E

V

V

A

A

D

W

L

L

V

V

A

S

F

F

L

L

A

A

S

S

D

E

R

K

A

A

A

N

Y

Y

I

I

T

T

G

G

Q

K

V

N

I

I

S

V

I

I

N

D

G

G

I

M

I

I

binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G10 (= G8), R13 (≠ G11), G14 (= G12), I15 (= I13), Y34 (= Y32), N35 (≠ H33), S36 (≠ G34), C56 (≠ F58), N57 (≠ D59), I58 (≠ V60), N84 (= N85), I135 (= I135), S137 (= S137), Y150 (= Y150), K154 (= K154), G181 (= G181), I183 (= I183), T185 (= T185), M187 (= M187)

5vt6A Crystal structure of acetoacetyl-coa reductase from burkholderia pseudomallei 1710b complexed with NADP
41% identity, 99% coverage: 2:238/239 of query aligns to 2:242/245 of 5vt6A

query
sites
5vt6A

R

R

Q

V

A

A

L

F

V

V

S

T

G
|
G

G

G

S

M

G
|
G

I
x
L

G

G

A

A

I

I

C

S

R

R

L

L

A

H

L

D

D

A

G

G

L

M

H

A

V

V

W

A

V

V

H

S

Y
x
H

H
x
S

G

E

H

R

R
x
N

Q

D

S

H

A

V

E

S

Q

T

V

W

V

L

D

M

A

H

I

E

R

R

V

D

G

A

G

G

G

R

S

D

A

F

E

K

A

A

I

Y

G

A

F
x
V

D
|
D

V
|
V

C

A

D

D

A

F

A

E

A

S

A

C

A

-

I

-

A

-

T

E

M

R

C

C

A

A

E

E

R

K

-

V

-

L

-

A

-

D

-

F

-

G

P

K

I

V

Q

D

V

V

L

L

V

I

N

N

N
|
N

A
|
A

G
|
G

I
|
I

H

T

D

R

D

D

A

A

V

T

F

F

P

M

A

K

M

M

R

T

S

K

D

G

Q
x
D

W

W

H

D

R

A

V

V

I

M

D

R

V

T

S

D

L

L

N

D

G

A

F

M

F

F

N

N

L

V

T

T

Q

K

P

Q

L

F

V

I

M

A

P

G

M

M

I

V

R

E

E

R

R

R

W

F

G

G

R

R

I

I

V

V

N

N

I
|
I

S

G

S
|
S

V

V

A

N

A

G

L

S

T

R

G

G

N

A

R

F

G

G

Q

Q

V

A

N

N

Y
|
Y

S

A

A

S

A

A

K
|
K

G

A

A

G

L

I

H

H

S

G

A

F

T

T

R

K

S

T

L

L

A

A

L

L

E

E

L

T

A

A

S

K

R

R

G

G

V

I

T

T

V

V

N

N

A

T

V

V

A

S

P
|
P

G

G

I
x
Y

I
x
L

E

A

T
|
T

G

A

M

M

A

V

E

E

S

A

A

V

F

P

D

Q

-

D

-

V

-

L

R

E

A

A

A

K

I

I

E

L

R

P

L

Q

V

I

P

P

M

V

K

G

R

R

A

L

G

G

R

R

P

P

E

D

E

E

V

V

A

A

D

A

L

L

V

I

A

A

F

F

L

L

A

C

S

S

D

D

R

D

A

A

A

G

Y

F

I

V

T

T

G

G

Q

A

V

D

I

L

S

A

I

I

N

N

G

G

I

M

active site: G12 (= G12), D102 (≠ Q101), S138 (= S137), Y151 (= Y150), K155 (= K154)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G8), G11 (= G11), G12 (= G12), L13 (≠ I13), H32 (≠ Y32), S33 (≠ H33), N36 (≠ R36), V58 (≠ F58), D59 (= D59), V60 (= V60), N86 (= N85), A87 (= A86), G88 (= G87), I89 (= I88), I136 (= I135), Y151 (= Y150), K155 (= K154), P181 (= P180), Y183 (≠ I182), L184 (≠ I183), T186 (= T185)

P14697 Acetoacetyl-CoA reductase; EC 1.1.1.36 from Cupriavidus necator (strain ATCC 17699 / DSM 428 / KCTC 22496 / NCIMB 10442 / H16 / Stanier 337) (Ralstonia eutropha) (see 2 papers)
41% identity, 99% coverage: 2:238/239 of query aligns to 4:243/246 of P14697

query
sites
P14697

R

R

Q

I

A

A

L

Y

V

V

S

T

G

G

S

M

G
|
G

I
|
I

G

G

A

T

A

A

I

I

C

C

R

Q

R

R

L

L

A

A

L

K

D

D

G

G

L

F

H

R

V

V

W

V

V

A

H

G

Y

C

H
x
G

G

P

H

N

R

S

Q

P

S
x
R

A

R

E

E

Q

K

V

W

V

L

D

E

A

-

I

-

R

-

V

-

G

-

S
x
Q

A

Q

E

K

A

A

I

L

G

G

F

F

D

D

-

F

-

I

-

A

-

S

-

E

-
x
G

-
x
N

V
|
V

C

A

D

D

A

W

A

D

A

S

A

T

A

K

A

T

A

A

I

F

A

D

T

K

M

V

C

K

A

S

E

E

-

V

R

G

P

E

I

V

Q

D

V

V

L

L

V

I

N

N

N
|
N

A
|
A

G
|
G

I
|
I

H
x
T

D

R

D
|
D

A

V

V

V

F

F

P

R

A
x
K

M

M

R

T

S

R

D

A

Q

D

W

W

H

D

R

A

V

V

I

I

D

D

V

T

S

N

L

L

N

T

G

S

F

L

F

F

N

N

L

V

T

T

Q

K

P

Q

L

V

V

I

M

D

P

G

M

M

I

A

R

D

E

R

R

G

W

W

G

G

R

R

I

I

V

V

N

N

I

I

S

S

V

V

A

N

A

G

L

Q

T

K

G

G

N
x
Q

R
x
F

G

G

Q
|
Q

V

T

N

N

Y

Y

S

S

A

T

A

A

K

K

G

A

A

G

L

L

H

H

S

G

A

F

T

T

R

M

S

A

L

L

A

A

L

Q

E

E

L

V

A

A

S
x
T

R

K

G

G

V

V

T

T

V

V

N

N

A

T

V

V

A

S

P
|
P

G
|
G

I
x
Y

I
|
I

E

A

T

T

G

D

M

M

A

V

E

K

S

-

A

A

F

I

D
x
R

R

Q

A

D

A

V

I

L

E

D

R

K

L

I

V

V

-

A

-

T

-

I

P

P

M

V

K

K

R

R

A

L

G

G

R

L

P

P

E

E

V

I

A

A

D

S

L

I

V

C

A

A

F

W

L

L

A

S

S

S

D

E

R

E

A

S

A

G

Y

F

I

S

T

T

G

G

Q

A

V

D

I

F

S

S

I

L

N

N

G

G

I

L

GGI 13:15 (= GGI 11:13) binding NADP(+)
G35 (≠ H33) binding NADP(+)
R40 (≠ S38) binding NADP(+)
Q47 (≠ S52) mutation to L: 2.4-fold increase in activity. 2-fold decrease in affinity for NADPH and 2.8-fold decrease in affinity for acetoacetyl-CoA.
GNV 60:62 (≠ --V 60) binding NADP(+)
NAGIT 88:92 (≠ NAGIH 85:89) binding NADP(+)
D94 (= D91) mutation to A: About 6% of wild-type activity.
K99 (≠ A96) mutation to A: Nearly loss of activity.
Q147 (≠ N144) mutation to A: About 30% of wild-type activity.
F148 (≠ R145) mutation to A: About 30% of wild-type activity.
Q150 (= Q147) mutation to A: About 20% of wild-type activity.
T173 (≠ S170) mutation to S: 3.5-fold increase in activity. 4-fold decrease in affinity for NADPH and 2.4-fold decrease in affinity for acetoacetyl-CoA.
PGYI 183:186 (≠ PGII 180:183) binding NADP(+)
Y185 (≠ I182) mutation to A: Nearly loss of activity.
R195 (≠ D193) mutation to A: Nearly loss of activity.

5vmlA Crystal structure of acetoacetyl-coa reductase from burkholderia pseudomallei 1710b with bound NADP
42% identity, 99% coverage: 2:238/239 of query aligns to 3:242/245 of 5vmlA

query
sites
5vmlA

R

R

Q

I

A

A

L

Y

V

V

S

T

G
|
G

G

G

S

M

G
|
G

I
|
I

G

G

A

T

A

S

I

I

C

C

R

Q

R

R

L

L

A

H

L

K

D

D

G

G

L

F

H

R

V

V

W

-

V

-

H

-

Y

V

H

A

G

G

H
x
C

R
x
G

Q

P

S

N

A

S

E

P

Q
x
R

V

R

V

V

D

K

A

W

I

L

R

E

V

-

G

-

S

D

A

Q

E

K

A

A

I

L

G

G

F

F

D

D

-

F

-

Y

-

A

-

S

-

E

-
x
G

-
x
N

V
|
V

C

G

D

D

A

W

A

D

A

S

A

T

A

K

A

Q

A

A

I

F

A

D

T

K

M

V

C

K

A

A

E

E

-

V

R

G

P

E

I

I

Q

D

V

V

L

L

V

V

N

N

N
|
N

A

A

G
|
G

I
|
I

H

T

D

R

D

D

A

V

V

V

F

F

P

R

A

K

M

M

R

T

S

R

D

E

Q

D

W

W

H

Q

R

A

V

V

I

I

D

D

V

T

S
x
N

L

L

N

T

G

S

F

L

F

F

N

N

L

V

T

T

Q

K

P

Q

L

V

V

I

M

D

P

G

M

M

I

V

R

E

E

R

R

G

W

W

G

G

R

R

I

I

V

I

N

N

I

I

S

S

S
|
S

V

V

A

N

A

G

L

Q

T

K

G

G

N

Q

R

F

G

G

Q

Q

V

T

N

N

Y
|
Y

S

S

A

T

A

A

K
|
K

G

A

A

G

L

I

H

H

S

G

A

F

T

T

R

M

S

S

L

L

A

A

L

Q

E

E

L

V

A

A

S

T

R

K

G

G

V

V

T

T

V

V

N

N

A

T

V

V

A

S

P
|
P

G
|
G

I

Y

I
|
I

E

G

T

T

G

D

M

M

A

V

E

K

S

-

A

A

F

I

D

R

R

P

A

D

A

V

I

L

E

E

R

K

L

I

V

V

-

A

-

T

-

I

P

P

M

V

K

R

R

R

A

L

G

G

R

S

P

P

E

D

E

E

V

I

A

G

D

S

L

I

V

V

A

A

F

W

L

L

A

A

S

S

D

E

R

E

A

S

A

G

Y

F

I

S

T

T

G

G

Q

A

V

D

I

F

S

S

I

L

N

N

G

G

I

L

active site: G13 (= G12), N111 (≠ S109), S139 (= S137), Y152 (= Y150), K156 (= K154)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G9 (= G8), G12 (= G11), G13 (= G12), I14 (= I13), C33 (≠ H35), G34 (≠ R36), R39 (≠ Q41), G59 (vs. gap), N60 (vs. gap), V61 (= V60), N87 (= N85), G89 (= G87), I90 (= I88), S139 (= S137), Y152 (= Y150), K156 (= K154), P182 (= P180), G183 (= G181), I185 (= I183)

4k6fB X-ray crystal structure of a putative acetoacetyl-coa reductase from burkholderia cenocepacia bound to the co-factor NADP
41% identity, 99% coverage: 2:237/239 of query aligns to 2:241/245 of 4k6fB

query
sites
4k6fB

R

R

Q

I

A

A

L

V

V

V

S

T

G
|
G

G

G

S

M

G

G

G
|
G

I

L

G

G

A

E

A

A

I

V

C

S

R

I

R

R

L

L

A

N

L

D

D

A

G

G

L

H

H

R

V

V

W

V

V

V

H

T

Y
|
Y

H
x
S

G

P

H

N

R
x
N

Q

T

S

G

A

A

E

D

Q

R

V

W

V

L

D

T

A

E

I

M

R

H

V

A

G

A

G

G

G

R

S

E

A

F

E

H

A

A

I

Y

G

P

F
x
V

D
|
D

V
|
V

C

A

D

D

A

H

A

D

A

S

A

C

A

Q

A

C

I

I

A

E

T

K

M

I

C

V

A

R

E

D

-

V

R

G

P

P

I

V

Q

D

V

I

L

L

V

V

N

N

A
|
A

G
|
G

I
|
I

H

T

D

R

D

D

A

M

V

T

F

L

P

R

A

K

M

L

R

D

S

K

D

V

Q
x
N

W

W

H

D

R

A

V

V

I

I

D

R

V

T

S

N

L

L

N

D

G

S

F

V

F

F

N

N

L

M

T

T

Q

K

P

P

L

V

V

C

M

D

P

G

M

M

I

V

R

E

E

R

R

G

W

W

G

G

R

R

I

I

V

V

N

N

I

I

S

S

S
|
S

V

V

A

N

A

G

L

S

T

K

G

G

N

S

R

V

G

G

Q

Q

V

T

N

N

Y
|
Y

S

A

A

A

K
|
K

G

A

A

G

L

M

H

H

S

G

A

F

T

T

R

K

S

S

L

L

A

A

L

L

E

E

L

I

A

A

S

R

R

K

G

G

V

V

T

T

V

V

N

N

A

T

V

V

A

S

P

P

G

G

I

Y

I

L

E

A

T

T

G

K

M

M

A

V

-

T

-

A

-

I

-

P

E

Q

S

D

A

I

F

L

D

D

R

T

A

K

A

I

I

L

E

P

R

Q

L

-

V

I

P

P

M

A

K

G

R

R

A

L

G

G

R

K

P

P

E

E

V

V

A

A

D

A

L

L

V

V

A

A

F

Y

L

L

A

C

S

S

D

E

R

E

A

A

A

G

Y

F

I

V

T

T

G

G

Q

S

V

N

I

I

S

A

I

I

N

N

G

G

active site: G12 (= G12), N102 (≠ Q101), S138 (= S137), Y151 (= Y150), K155 (= K154)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G8), Y32 (= Y32), S33 (≠ H33), N36 (≠ R36), V58 (≠ F58), D59 (= D59), V60 (= V60), A87 (= A86), G88 (= G87), I89 (= I88)

3vzsB Crystal structure of phab from ralstonia eutropha in complex with acetoacetyl-coa and NADP (see paper)
41% identity, 99% coverage: 2:238/239 of query aligns to 7:246/249 of 3vzsB

query
sites
3vzsB

R

R

Q

I

A

A

L

Y

V

V

S

T

G
|
G

G

G

S

M

G

G

I
|
I

G

G

A

T

A

A

I

I

C

C

R

Q

R

R

L

L

A

A

L

K

D

D

G

G

L

F

H

R

V

V

W

V

V

A

H

G

Y

C

H
x
G

G

P

H

N

R

S

Q

P

S
x
R

A

R

E

E

Q

K

V

W

V

L

D

E

A

-

I

-

R

-

V

-

G

-

S

Q

A

Q

E

K

A

A

I

L

G

G

F

F

D

D

-

F

-

I

-

A

-

S

-

E

-
x
G

-
x
N

V
|
V

C

A

D

D

A

W

A

D

A

S

A

T

A

K

A

T

A

A

I

F

A

D

T

K

M

V

C

K

A

S

E

E

-

V

R

G

P

E

I

V

Q

D

V

V

L

L

V

I

N

N

A

A

G
|
G

I
|
I

H
x
T

D

R

D
|
D

A

V

V

V

F

F

P

R

A

K

M

M

R

T

S

R

D

A

Q

D

W

W

H

D

R

A

V

V

I

I

D

D

V

T

S
x
N

L

L

N

T

G

S

F

L

F

F

N

N

L

V

T

T

Q

K

P

Q

L

V

V

I

M

D

P

G

M

M

I

A

R

D

E

R

R

G

W

W

G

G

R

R

I

I

V

V

N

N

I

I

S

S

S
|
S

V

V

A

N

A

G

L

Q

T

K

G

G

N
x
Q

R
x
F

G

G

Q
|
Q

V

T

N

N

Y
|
Y

S

S

A

T

A

A

K
|
K

G

A

A

G

L

L

H

H

S

G

A

F

T

T

R

M

S

A

L

L

A

A

L

Q

E

E

L

V

A

A

S

T

R

K

G

G

V

V

T

T

V

V

N

N

A

T

V

V

A

S

P
|
P

G
|
G

I
x
Y

I
|
I

E

A

T

T

G

D

M
|
M

A
x
V

E

K

S

-

A

A

F

I

D
x
R

R

Q

A

D

A

V

I

L

E

D

R

K

L

I

V

V

-

A

-

T

-

I

P

P

M

V

K

K

R

R

A

L

G

G

R

L

P

P

E

E

V

I

A

A

D

S

L

I

V

C

A

A

F

W

L

L

A

S

S

S

D

E

R

E

A

S

A

G

Y

F

I

S

T

T

G

G

Q

A

V

D

I

F

S

S

I

L

N

N

G

G

I

L

active site: N115 (≠ S109), S143 (= S137), Y156 (= Y150), K160 (= K154)
binding acetoacetyl-coenzyme a: D97 (= D91), Q150 (≠ N144), F151 (≠ R145), Q153 (= Q147), Y156 (= Y150), G187 (= G181), Y188 (≠ I182), R198 (≠ D193)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G13 (= G8), I18 (= I13), G38 (≠ H33), R43 (≠ S38), G63 (vs. gap), N64 (vs. gap), V65 (= V60), G93 (= G87), I94 (= I88), T95 (≠ H89), P186 (= P180), I189 (= I183), M193 (= M187), V194 (≠ A188)

6t77A Crystal structure of klebsiella pneumoniae fabg(NADPH-dependent) NADP- complex at 1.75 a resolution (see paper)
41% identity, 98% coverage: 4:238/239 of query aligns to 8:241/244 of 6t77A

query
sites
6t77A

A

A

L

L

V

V

S

T

G
|
G

G

A

S
|
S

G
x
R

G
|
G

I

I

G

G

A

R

A

A

I

I

C

A

R

E

R

T

L

L

A

V

L

A

D

R

G

G

L

A

H

K

V

V

W

-

V

I

H

G

Y

T

H

A

G
x
T

H

S

R

E

Q

S

S

G

A

A

E

Q

Q

A

V

I

V

S

D

D

A

Y

I

L

R

-

V

-

G

-

G

G

G

A

S

N

A

G

E

K

A

G

I

L

G

M

F
x
L

D
x
N

V
|
V

C

T

D

D

A

P

A

A

A

S

A

I

A

E

A

S

A

V

I

L

A

E

T

N

M

V

C

R

A

A

E

E

R

F

-

G

P

E

I

V

Q

D

V

I

L

L

V

V

N

N

A
|
A

G
|
G

I
|
I

H

T

D

R

D

D

A

N

V

L

F

L

P

M

A

R

M

M

R

K

S

D

D

D

Q

E

W

W

H

N

R

D

V

I

I

I

D

E

V

T

S

N

L

L

N

S

G

S

F

V

F

F

N

R

L

L

T

S

Q

K

P

A

L

V

V

M

M

R

P

A

M

M

I

M

R

K

E

K

R

R

W

H

G

G

R

R

I

I

V

I

N

T

I

I

S

G

S
|
S

V

V

A

V

A

G

L

T

T

M

G

G

N

N

R

A

G

G

Q

Q

V

A

N

N

Y
|
Y

S

A

A

A

K

K

G

A

A

G

L

L

H

I

S

G

A

F

T

S

R

K

S

S

L

L

A

A

L

R

E

E

L

V

A

A

S

S

R

R

G

G

V

I

T

T

V

V

N

N

A

V

V

V

A

A

P

P

G

G

I

F

I

I

E

E

T

T

G

D

M

M

A

T

E

R

S

A

A

L

F

T

D

D

-

E

-

Q

R

R

A

A

A

G

I

T

E

L

R

A

L

A

V

V

P

P

M

A

K

G

R

R

A

L

G

G

R

T

P

P

E

N

E

E

V

I

A

A

D

S

L

A

V

V

A

A

F

F

L

L

A

A

S

S

D

D

R

E

A

A

A

S

Y

Y

I

I

T

T

G

G

Q

E

V

T

I

L

S

H

I

V

N

N

G

G

I

M

active site: G16 (= G12), S138 (= S137), Y151 (= Y150)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G12 (= G8), S14 (= S10), R15 (≠ G11), T37 (≠ G34), L58 (≠ F58), N59 (≠ D59), V60 (= V60), A87 (= A86), G88 (= G87), I89 (= I88)

P0AEK2 3-oxoacyl-[acyl-carrier-protein] reductase FabG; 3-ketoacyl-acyl carrier protein reductase; Beta-Ketoacyl-acyl carrier protein reductase; Beta-ketoacyl-ACP reductase; EC 1.1.1.100 from Escherichia coli (strain K12) (see 2 papers)
42% identity, 98% coverage: 4:238/239 of query aligns to 8:241/244 of P0AEK2

query
sites
P0AEK2

A

A

L

L

V

V

S

T

G
|
G

G
x
A

S
|
S

G
x
R

G

G

I

I

G

G

A

R

A

A

I

I

C

A

R

E

R

T

L

L

A

A

L

A

D

R

G

G

L

A

H

K

V

V

W

-

V

I

H

G

Y

T

H

A

G
x
T

H

S

R

E

Q

N

S

G

A

A

E

Q

Q

A

V

I

V

S

D

D

A

Y

I

L

R

-

V

-

G

-

G

G

G

A

S

N

A

G

E

K

A

G

I

L

G

M

F

L

D
x
N

V
|
V

C

T

D

D

A

P

A

A

A

S

A

I

A

E

A

S

A

V

I

L

A

E

T

K

M

I

C

R

A

A

E

E

R

F

-

G

P

E

I

V

Q

D

V

I

L

L

V

V

N

N

N
|
N

A

A

G

G

I

I

H

T

D

R

D

D

A

N

V

L

F

L

P

M

A

R

M

M

R

K

S

D

D

E

Q

E

W

W

H

N

R

D

V

I

I

I

D

E

V

T

S

N

L

L

N

S

G

S

F

V

F

F

N

R

L

L

T

S

Q

K

P

A

L

V

V

M

M

R

P

A

M

M

I

M

R

K

E

K

R

R

W

H

G

G

R

R

I

I

V

I

N

T

I

I

S

G

S

S

V

V

A

V

A

G

L

T

T

M

G

G

N

N

R

G

G

G

Q

Q

V

A

N

N

Y
|
Y

S
x
A

A
|
A

K
|
K

G

A

A

G

L

L

H

I

S

G

A

F

T

S

R

K

S

S

L

L

A

A

L

R

E

E

L

V

A

A

S

S

R

R

G

G

V

I

T

T

V

V

N

N

A

V

V

V

A

A

P

P

G

G

I

F

I
|
I

E

E

T

T

G

D

M

M

A

T

E

R

S

A

A

L

F

S

D

D

-

D

-

Q

R

R

A

A

A

G

I

I

E

L

R

A

L

Q

V

V

P

P

M

A

K

G

R

R

A

L

G

G

R

G

P

A

E

Q

E

E

V

I

A

A

D

N

L

A

V

V

A

A

F

F

L

L

A

A

S

S

D

D

R

E

A

A

Y

Y

I

I

T

T

G

G

Q
x
E

V

T

I

L

S

H

I

V

N

N

G

G

I

M

GASR 12:15 (≠ GGSG 8:11) binding NADP(+)
T37 (≠ G34) binding NADP(+)
NV 59:60 (≠ DV 59:60) binding NADP(+)
N86 (= N85) binding NADP(+)
Y151 (= Y150) mutation to F: Defect in the affinity for NADPH.
YAAAK 151:155 (≠ YSAAK 150:154) binding NADP(+)
A154 (= A153) mutation to T: Decreases in the thermolability of the reductase; when associated with K-233.
K155 (= K154) mutation to A: Defect in the affinity for NADPH.
I184 (= I183) binding NADP(+)
E233 (≠ Q230) mutation to K: Decreases in the thermolability of the reductase; when associated with T-154.

1q7bA The structure of betaketoacyl-[acp] reductase from e. Coli in complex with NADP+ (see paper)
42% identity, 98% coverage: 4:238/239 of query aligns to 7:240/243 of 1q7bA

query
sites
1q7bA

A

A

L

L

V

V

S

T

G
|
G

G

A

S
|
S

G
x
R

G
|
G

I

I

G

G

A

R

A

A

I

I

C

A

R

E

R

T

L

L

A

A

L

A

D

R

G

G

L

A

H

K

V

V

W

-

V

I

H

G

Y

T

H

A

G
x
T

H

S

R

E

Q

N

S

G

A

A

E

Q

Q

A

V

I

V

S

D

D

A

Y

I

L

R

-

V

-

G

-

G

G

G

A

S

N

A

G

E

K

A

G

I

L

G

M

F

L

D
x
N

V
|
V

C

T

D

D

A

P

A

A

A

S

A

I

A

E

A

S

A

V

I

L

A

E

T

K

M

I

C

R

A

A

E

E

R

F

-

G

P

E

I

V

Q

D

V

I

L

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I
|
I

H

T

D

R

D

D

A

N

V

L

F

L

P

M

A

R

M

M

R

K

S

D

D

E

Q
x
E

W

W

H

N

R

D

V

I

I

I

D

E

V

T

S

N

L

L

N

S

G

S

F

V

F

F

N

R

L

L

T

S

Q

K

P

A

L

V

V

M

M

R

P

A

M

M

I

M

R

K

E

K

R

R

W

H

G

G

R

R

I

I

V

I

N

T

I

I

S

G

S
|
S

V

V

A

V

A

G

L

T

T

M

G

G

N

N

R

G

G

G

Q
|
Q

V

A

N

N

Y
|
Y

S

A

A

A

K
|
K

G

A

A

G

L

L

H

I

S

G

A

F

T

S

R

K

S

S

L

L

A

A

L

R

E

E

L

V

A

A

S

S

R

R

G

G

V

I

T

T

V

V

N

N

A

V

V

V

A

A

P
|
P

G
|
G

I

F

I
|
I

E

E

T

T

G

D

M

M

A

T

E

R

S

A

A

L

F

S

D

D

-

D

-

Q

R

R

A

A

A

G

I

I

E

L

R

A

L

Q

V

V

P

P

M

A

K

G

R

R

A

L

G

G

R

G

P

A

E

Q

E

E

V

I

A

A

D

N

L

A

V

V

A

A

F

F

L

L

A

A

S

S

D

D

R

E

A

A

Y

Y

I

I

T

T

G

G

Q
x
E

V
x
T

I

L

S

H

I

V

N

N

G

G

I

M

active site: G15 (= G12), E101 (≠ Q101), S137 (= S137), Q147 (= Q147), Y150 (= Y150), K154 (= K154)
binding calcium ion: E232 (≠ Q230), T233 (≠ V231)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G11 (= G8), S13 (= S10), R14 (≠ G11), T36 (≠ G34), N58 (≠ D59), V59 (= V60), N85 (= N85), A86 (= A86), G87 (= G87), I88 (= I88), S137 (= S137), Y150 (= Y150), K154 (= K154), P180 (= P180), G181 (= G181), I183 (= I183)

P0A2C9 3-oxoacyl-[acyl-carrier-protein] reductase FabG; 3-ketoacyl-acyl carrier protein reductase; Beta-Ketoacyl-acyl carrier protein reductase; Beta-ketoacyl-ACP reductase; EC 1.1.1.100 from Salmonella typhimurium (strain LT2 / SGSC1412 / ATCC 700720) (see paper)
41% identity, 98% coverage: 4:238/239 of query aligns to 8:241/244 of P0A2C9

query
sites
P0A2C9

A

A

L

L

V

V

S

T

G

G

G

A

S

S

G

R

G

G

I

I

G

G

A

R

A

A

I

I

C

A

R

E

R

T

L

L

A

V

L

A

D

R

G

G

L

A

H

K

V

V

W

-

V

I

H

G

Y

T

H

A

G

T

H

S

R

E

Q

N

S

G

A

A

E

K

Q

N

V

I

V

S

D

D

A

Y

I

L

R

-

V

-

G

-

G

G

G

A

S

N

A

G

E

K

A

G

I

L

G

M

F

L

D

N

V

V

C

T

D

D

A

P

A

A

A

S

A

I

A

E

A

S

A

V

I

L

A

E

T

N

M

I

C

R

A

A

E

E

R

F

-

G

P

E

I

V

Q

D

V

I

L

L

V

V

N

N

A

A

G

G

I

I

H

T

D

R

D

D

A

N

V

L

F

L

P

M

A

R

M

M

R

K

S

D

D

D

Q

E

W

W

H

N

R

D

V

I

I

I

D

E

V

T

S

N

L

L

N

S

G

S

F

V

F

F

N

R

L

L

T

S

Q

K

P

A

L

V

V

M

M

R

P

A

M
|
M

I

M

R

K

E

K

R

R

W

C

G

G

R

R

I

I

V

I

N

T

I

I

S

G

S

S

V

V

A

V

A

G

L

T

T

M

G

G

N

N

R

A

G

G

Q

Q

V

A

N

N

Y

Y

S

A

A

A

K

K

G

A

A

G

L

L

H

I

S

G

A

F

T

S

R

K

S

S

L

L

A

A

L

R

E

E

L

V

A

A

S

S

R

R

G

G

V

I

T

T

V

V

N

N

A

V

V

V

A

A

P

P

G

G

I

F

I

I

E

E

T

T

G

D

M

M

A

T

E

R

S

A

A

L

F

S

D

D

-

D

-

Q

R

R

A

A

A

G

I

I

E

L

R

A

L

Q

V

V

P

P

M

A

K

G

R

R

A

L

G

G

R

G

P

A

E

Q

E

E

V

I

A

A

D

S

L

A

V

V

A

A

F

F

L

L

A
|
A

S
|
S

D

D

R

E

A

A

A

S

Y

Y

I

I

T

T

G

G

Q

E

V

T

I

L

S

H

I

V

N

N

G

G

I

M

M125 (= M124) mutation to I: Loss of the temperature-sensitive phenotype; when associated with T-223.
A223 (= A220) mutation to T: Loss of the temperature-sensitive phenotype; when associated with I-125.
S224 (= S221) mutation to F: Distorts the local conformation and prevent stacking around Phe-221. The S224F mutation would additionally disrupt the hydrogen bond formed between Ser-224 and Glu-226.

1q7cA The structure of betaketoacyl-[acp] reductase y151f mutant in complex with NADPH fragment (see paper)
41% identity, 98% coverage: 4:238/239 of query aligns to 7:240/243 of 1q7cA

query
sites
1q7cA

A

A

L

L

V

V

S

T

G
|
G

G

A

S
|
S

G
x
R

G
|
G

I

I

G

G

A

R

A

A

I

I

C

A

R

E

R

T

L

L

A

A

L

A

D

R

G

G

L

A

H

K

V

V

W

-

V

I

H

G

Y

T

H
x
A

G
x
T

H

S

R

E

Q

N

S

G

A

A

E

Q

Q

A

V

I

V

S

D

D

A

Y

I

L

R

-

V

-

G

-

G

G

G

A

S

N

A

G

E

K

A

G

I

L

G

M

F
x
L

D
x
N

V
|
V

C

T

D

D

A

P

A

A

A

S

A

I

A

E

A

S

A

V

I

L

A

E

T

K

M

I

C

R

A

A

E

E

R

F

-

G

P

E

I

V

Q

D

V

I

L

L

V

V

N

N

A

A

G
|
G

I
|
I

H

T

D

R

D

D

A

N

V

L

F

L

P

M

A

R

M

M

R

K

S

D

D

E

Q

E

W

W

H

N

R

D

V

I

I

I

D

E

V

T

S

N

L

L

N

S

G

S

F

V

F

F

N

R

L

L

T

S

Q

K

P

A

L

V

V

M

M

R

P

A

M

M

I

M

R

K

E

K

R

R

W

H

G

G

R

R

I

I

V

I

N

T

I

I

S

G

S
|
S

V

V

A

V

A

G

L

T

T

M

G

G

N

N

R

G

G

G

Q
|
Q

V

A

N

N

Y
x
F

S

A

A

A

K
|
K

G

A

A

G

L

L

H

I

S

G

A

F

T

S

R

K

S

S

L

L

A

A

L

R

E

E

L

V

A

A

S

S

R

R

G

G

V

I

T

T

V

V

N

N

A

V

V

V

A

A

P

P

G

G

I

F

I

I

E

E

T

T

G

D

M

M

A

T

E

R

S

A

A

L

F

S

D

D

-

D

-

Q

R

R

A

A

A

G

I

I

E

L

R

A

L

Q

V

V

P

P

M

A

K

G

R

R

A

L

G

G

R

G

P

A

E

Q

E

E

V

I

A

A

D

N

L

A

V

V

A

A

F

F

L

L

A

A

S

S

D

D

R

E

A

A

Y

Y

I

I

T

T

G

G

Q

E

V

T

I

L

S

H

I

V

N

N

G

G

I

M

active site: G15 (= G12), S137 (= S137), Q147 (= Q147), F150 (≠ Y150), K154 (= K154)
binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G11 (= G8), S13 (= S10), R14 (≠ G11), A35 (≠ H33), T36 (≠ G34), L57 (≠ F58), N58 (≠ D59), V59 (= V60), G87 (= G87), I88 (= I88)

4jroC Crystal structure of 3-oxoacyl-[acyl-carrier protein]reductase (fabg) from listeria monocytogenes in complex with NADP+
39% identity, 100% coverage: 2:239/239 of query aligns to 6:246/247 of 4jroC

query
sites
4jroC

R

K

Q

V

A

A

L

V

V

V

S

T

G
|
G

G

G

S
|
S

G
x
R

G
|
G

I
|
I

G

G

A

R

A

D

I

I

C

A

R

I

R

N

L

L

A

A

L

K

D

E

G

G

L

A

H

N

V

I

W

F

V

F

H
x
N

Y
|
Y

H
x
N

G
|
G

H
x
S

R

P

Q

E

S

A

A

A

E

E

Q

E

V

T

V

A

D

K

A

L

I

V

R

A

V

E

G

H

G

G

G

V

S

E

A

V

E

E

A

A

I

M

G

K

F

A

D
x
N

V
|
V

C

A

D

-

A

I

A

A

A

E

A

D

A

V

A

D

A

A

I

F

A

F

T

K

M

Q

C

A

A

I

E

E

R

R

-

F

-

G

P

R

I

V

Q

D

V

I

L

L

V

V

N

N

N
|
N

A
|
A

G

G

I
|
I

H

T

D

R

D

D

A

N

V

L

F

L

P

M

A

R

M

M

R

K

S

E

D

D

Q

E

W

W

H

D

R

D

V

V

I

I

D

N

V
x
I

S

N

L

L

N

K

G

G

F

T

F

F

N

L

L

C

T

T

Q

K

P

A

L

V

V

S

M

R

P

T

M

M

I

M

R

K

E

Q

R

R

W

A

G

G

R

K

I

I

V

I

N

N

I

M

S

A

S
|
S

V

V

A

V

A

G

L

L

T

I

G

G

N

N

R

A

G

G

Q
|
Q

V

A

N

N

Y
|
Y

S

V

A

A

A

S

K
|
K

G

A

A

G

L

V

H

I

S

G

A

L

T

T

R

K

S

T

L

T

A

A

L

R

E

E

L

L

A

A

S

P

R

R

G

G

V

I

T

N

V

V

N

N

A

A

V

V

A

A

P
|
P

G

G

I

F

I
|
I

E

T

T
|
T

G

D

M

M

A

T

E

D

S

K

A

-

F

L

D

D

R

E

A

K

A

T

I

K

E

E

R

A

L

M

-

L

-

A

-

Q

V

I

P

P

M

L

K

G

R

A

A

Y

G

G

R

T

P

T

E

E

E

D

V

I

A

A

D

N

L

A

V

V

A

L

F

F

L

L

A

A

S

S

D

D

R

A

A

S

A

K

Y

Y

I

I

T

T

G

G

Q

Q

V

T

I

L

S

S

I

V

N

D

G

G

I

M

I

V

active site: G16 (= G12), S142 (= S137), Q152 (= Q147), Y155 (= Y150), K159 (= K154)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G12 (= G8), S14 (= S10), R15 (≠ G11), G16 (= G12), I17 (= I13), N35 (≠ H31), Y36 (= Y32), N37 (≠ H33), G38 (= G34), S39 (≠ H35), N63 (≠ D59), V64 (= V60), N90 (= N85), A91 (= A86), I93 (= I88), I113 (≠ V108), S142 (= S137), Y155 (= Y150), K159 (= K154), P185 (= P180), I188 (= I183), T190 (= T185)

7emgB Carbonyl reductase variant 4 (r123c/l209p/f183y/v61k) from serratia marcescens complexed with NADP+ (see paper)
41% identity, 98% coverage: 5:238/239 of query aligns to 8:240/243 of 7emgB

query
sites
7emgB

L

L

V

V

S

T

G
|
G

G

A

S
|
S

G
x
R

G

G

I

I

G

G

A

R

A

A

I

I

C

A

R

E

R

T

L

F

A

V

L

A

D

R

G

G

L

A

H

K

V

V

W

-

V

I

H

G

Y

T

H

A

G
x
T

H

S

R

E

Q

S

S

G

A

A

E

E

Q

A

V

I

V

S

D

G

A

Y

I

L

R

-

V

-

G

-

G

G

G

A

S

N

A

G

E

K

A

G

I

F

G

M

F

L

D
x
N

V
|
V

C

K

D

D

A

A

A

Q

A

S

A

I

A

D

A

S

A

V

I

L

A

A

T

S

M

I

C

R

A

A

E

E

R

F

-

G

P

E

I

I

Q

D

V

I

L

L

V

V

N

N

A

A

G

G

I
|
I

H

T

D

R

D

D

A

N

V

L

F

L

P

M

A

R

M

M

R

K

S

D

D

D

Q

E

W

W

H

E

R

D

V

I

I

L

D

D

V

T

S

N

L

L

N

T

G

S

F

V

F

F

N

R

L

L

T

S

Q

K

P

A

L

V

V

M

M

C

P

A

M

M

I

M

R

K

E

K

R

R

W

F

G

G

R

R

I

I

V

I

N

T

I

I

S

G

S

S

V

V

A

V

A

G

L

T

T

M

G

G

N

N

R

A

G

G

Q

Q

V

A

N

N

Y

Y

S

A

A

A

K

K

G

A

A

G

L

L

H

I

S

G

A

F

T

S

R

K

S

S

L

L

A

A

L

R

E

E

L

V

A

A

S

S

R

R

G

G

V

I

T

T

V

V

N

N

A

V

V

V

A

A

P

P

G

G

I

Y

I

I

E

E

T

T

G

D

M

M

A

T

E

R

S

A

A

L

F

T

D

D

-

D

-

Q

R

R

A

A

A

G

I

I

E

L

R

S

L

S

V

V

P

P

M

A

K

N

R

R

A

P

G

G

R

D

P

A

E

K

E

E

V

I

A

A

D

S

L

A

V

V

A

A

F

F

L

L

A

A

S

S

D

D

R

E

A

A

A

G

Y

Y

I

I

T

T

G

G

Q

E

V

T

I

L

S

H

I

V

N

N

G

G

I

M

binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G11 (= G8), S13 (= S10), R14 (≠ G11), T36 (≠ G34), N58 (≠ D59), V59 (= V60), I88 (= I88)

4ag3A Crystal structure of 3-ketoacyl-(acyl-carrier-protein) reductase (fabg) from pseudomonas aeruginosa in complex with NADPH at 1.8a resolution (see paper)
39% identity, 99% coverage: 2:238/239 of query aligns to 13:251/254 of 4ag3A

query
sites
4ag3A

R

K

Q

V

A

A

L

L

V

V

S

T

G
|
G

G

A

S
|
S

G
x
R

G
|
G

I
|
I

G

G

A

Q

A

A

I

I

C

A

R

L

R

E

L

L

A

G

L

R

D

L

G

G

L

-

H

A

V

V

W

V

V

I

H

G

Y

T

H

A

G
x
T

H

S

R

A

Q

S

S

G

A

A

E

E

Q

K

V

I

V

A

D

E

A

T

I

L

R

K

V

A

G

N

G

G

G

V

S

E

A

G

E

A

A

G

I

L

G

V

F
x
L

D
|
D

V
|
V

C

S

D

S

A

D

A

E

A

S

A

V

A

A

A

T

I

L

A

E

T

H

M

I

C

Q

A

Q

E

H

-

L

-

G

R

Q

P

P

I

L

Q

-

V

I

L

V

V

V

N

N

N
|
N

A
|
A

G

G

I

I

H

T

D

R

D

D

A

N

V

L

F

L

P

V

A

R

M

M

R

K

S

D

D

D

Q

E

W

W

H

F

R

D

V

V

I

V

D

N

V

T

S

N

L

L

N

N

G

S

F

L

F

Y

N

R

L

L

T

S

Q

K

P

A

L

V

V

L

M

R

P

G

M

M

I

T

R

K

E

A

R

R

W

W

G

G

R

R

I

I

V

I

N

N

I
|
I

S

G

S
|
S

V

V

A

V

A

G

L

A

T

M

G

G

N

N

R

A

G

G

Q

Q

V

T

N

N

Y
|
Y

S

A

A

A

K
|
K

G

A

A

G

L

L

H

E

S

G

A

F

T

T

R

R

S

A

L

L

A

A

L

R

E

E

L

V

A

G

S

S

R

R

G

A

V

I

T

T

V

V

N

N

A

A

V

V

A

A

P
|
P

G
|
G

I
x
F

I
|
I

E

D

T
|
T

G

D

M
|
M

A
x
T

E

R

S

E

A

L

F

P

D

E

-

A

-

Q

R

R

A

E

A

A

I

L

E

L

R

G

L

Q

V

I

P

P

M

L

K

G

R

R

A

L

G

G

R

Q

P

A

E

E

V

I

A

A

D

K

L

V

V

V

A

G

F

F

L

L

A

A

S

S

D

D

R

G

A

A

Y

Y

I

V

T

T

G

G

Q

A

V

T

I

V

S

P

I

V

N

N

G

G

I

M

active site: G23 (= G12), S148 (= S137), Y161 (= Y150), K165 (= K154)
binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G19 (= G8), S21 (= S10), R22 (≠ G11), G23 (= G12), I24 (= I13), T44 (≠ G34), L68 (≠ F58), D69 (= D59), V70 (= V60), N96 (= N85), A97 (= A86), I146 (= I135), S148 (= S137), Y161 (= Y150), K165 (= K154), P191 (= P180), G192 (= G181), F193 (≠ I182), I194 (= I183), T196 (= T185), M198 (= M187), T199 (≠ A188)

6wprA Crystal structure of a putative 3-oxoacyl-acp reductase (fabg) with NADP(h) from acinetobacter baumannii (see paper)
40% identity, 98% coverage: 4:238/239 of query aligns to 8:241/244 of 6wprA

query
sites
6wprA

A

A

L

L

V

V

S

T

G
|
G

G

A

S
|
S

G
x
R

G
|
G

I

I

G

G

A

A

I

I

C

A

R

Q

L

L

A

I

L

Q

D

D

G

G

L

Y

H

F

V

V

W

-

V

V

H

G

Y

T

H

A

G
x
T

H

S

R

E

Q

S

S

G

A

A

E

Q

Q

K

V

L

V

T

D

D

A

S

I

F

R

-

V

-

G

-

G

G

G

E

S

Q

A

G

E

A

A

G

I

L

G

A

F
x
L

D
|
D

V
|
V

C

R

D

N

A

L

A

D

A

E

A

I

A

E

A

A

A

V

I

V

A

S

T

H

M

I

C

E

A

Q

E

N

R

Y

-

G

P

P

I

V

Q

L

V

V

L

L

V

V

N

N

N
|
N

A
|
A

G
|
G

I
|
I

H

T

D

K

D

D

A

N

V

L

F

L

P

L

A

R

M

M

R

S

S

E

D

D

Q

D

W

W

H

D

R

D

V

I

I

L

D

N

V

I

S

H

L

L

N

K

G

A

F

V

F

Y

N

R

L

L

T

S

Q

K

P

R

L

V

V

L

M

K

P

G

M

M

I

T

R

K

E

A

R

R

W

F

G

G

R

R

I

I

V

I

N

N

I
|
I

S

S

S
|
S

V

V

A

V

A

A

L

H

T

F

G

A

N

N

R

P

G

G

Q

Q

V

A

N

N

Y
|
Y

S

S

A

A

K
|
K

G

A

A

G

L

I

H

E

S

A

A

F

T

S

R

R

S

S

L

L

A

A

L

K

E

E

L

M

A

G

S

S

R

R

G

Q

V

I

T

T

V

V

N

N

A

S

V

V

A

A

P
|
P

G

G

I

F

I

I

E

A

T

T

G

E

M

M

A

T

E

D

S

A

A

L

F

S

D

E

-

D

-

I

R

R

A

K

I

M

E

S

R

D

L

Q

V

V

P

A

M

L

K

N

R

R

A

L

G

G

R

E

P

P

E

Q

E

D

V

I

A

A

D

N

L

A

V

V

A

S

F

F

L

L

A

A

S

S

D

D

R

K

A

A

A

G

Y

Y

I

I

T

T

G

G

Q

T

V

V

I

L

S

H

I

V

N

N

G

G

I

L

active site: G16 (= G12), S138 (= S137), Y151 (= Y150)
binding nadph dihydro-nicotinamide-adenine-dinucleotide phosphate: G12 (= G8), S14 (= S10), R15 (≠ G11), T37 (≠ G34), L58 (≠ F58), D59 (= D59), V60 (= V60), N86 (= N85), A87 (= A86), G88 (= G87), I89 (= I88), I136 (= I135), Y151 (= Y150), K155 (= K154), P181 (= P180)

Query Sequence

>WP_010960235.1 NCBI__GCF_000008325.1:WP_010960235.1
MRQALVSGGSGGIGAAICRRLALDGLHVWVHYHGHRQSAEQVVDAIRVGGGSAEAIGFDV
CDAAAAAAAIATMCAERPIQVLVNNAGIHDDAVFPAMRSDQWHRVIDVSLNGFFNLTQPL
VMPMIRERWGRIVNISSVAALTGNRGQVNYSAAKGALHSATRSLALELASRGVTVNAVAP
GIIETGMAESAFDRAAIERLVPMKRAGRPEEVADLVAFLASDRAAYITGQVISINGGII

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