SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing WP_075859551.1 NCBI__GCF_001950255.1:WP_075859551.1 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)

Q04797 Aspartate-semialdehyde dehydrogenase; ASA dehydrogenase; ASADH; Aspartate-beta-semialdehyde dehydrogenase; EC 1.2.1.11 from Bacillus subtilis (strain 168) (see paper)
53% identity, 98% coverage: 4:335/339 of query aligns to 6:346/346 of Q04797

query
sites
Q04797

N

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S98 (= S95) modified: Phosphoserine
Y146 (≠ G143) modified: Phosphotyrosine

8jusA Crystal structure of aspartate semialdehyde dehydrogenase from porphyromonas gingivalis complexed with 2',5'adenosine diphosphate
53% identity, 97% coverage: 5:333/339 of query aligns to 3:333/335 of 8jusA

query
sites
8jusA

V

I

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x
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G

G

binding adenosine-2'-5'-diphosphate: G7 (= G9), S9 (≠ T11), G10 (= G12), G34 (≠ A36), S35 (≠ T37), R37 (= R39), S38 (= S40), S70 (vs. gap), A71 (= A71), T75 (≠ A75)

P23247 Aspartate-semialdehyde dehydrogenase 2; ASA dehydrogenase 2; ASADH 2; Aspartate-beta-semialdehyde dehydrogenase 2; EC 1.2.1.11 from Vibrio cholerae serotype O1 (strain ATCC 39315 / El Tor Inaba N16961) (see paper)
52% identity, 97% coverage: 3:331/339 of query aligns to 5:334/337 of P23247

query
sites
P23247

Y

F

N

N

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C132 (= C127) active site, Acyl-thioester intermediate

2r00C Crystal structure of aspartate semialdehyde dehydrogenase ii complexed with asa from vibrio cholerae (see paper)
52% identity, 97% coverage: 3:331/339 of query aligns to 4:333/336 of 2r00C

query
sites
2r00C

Y

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Q

-

Y

F

P

P

M

T

P

Q

L

V

F

R

-

D

A

A

S

G

D

G

R

K

D

D

E

H

V

V

Y

L

V

V

G

G

R

R

I

V

R

R

E

N

D

D

N

I

T

S

I

H

S

H

N

S

G

G

L

I

N

N

L

L

W

W

V

V

A

A

D

D

Q
x
N

L

V

R

R

K

K

G

G

A

A

T

T

N

N

A

A

V

V

Q

Q

I

I

A

A

E

E

L

L

I

V

K

R

active site: C131 (= C127), Q158 (= Q154), R237 (= R233), H244 (= H240)
binding 2,2'-oxydiacetic acid: V15 (= V14), N95 (= N93), C131 (= C127), N315 (≠ Q313)

4r5hA Crystal structure of sp-aspartate-semialdehyde-dehydrogenase with nicotinamide-adenine-dinucleotide-phosphate and 3-carboxy-propenyl- phthalic acid (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/359 of 4r5hA

query
sites
4r5hA

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-
x
S

A
|
A

G
|
G

G
x
S

S

S

A
x
T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P
|
P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G
|
G

A

A

G
|
G

I
x
M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E

E

W

M

K
|
K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H
|
H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G
|
G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

binding 3-[(1E)-3-carboxyprop-1-en-1-yl]benzene-1,2-dicarboxylic acid: S73 (≠ G73), T94 (≠ S94), S95 (= S95), R98 (= R98), N126 (= N126), C127 (= C127), Q154 (= Q154), G158 (= G158), K222 (= K211), R244 (= R233), H251 (= H240)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (= A13), V13 (= V14), A35 (= A36), S36 (≠ T37), R38 (= R39), S39 (= S40), T56 (= T57), S70 (vs. gap), A71 (= A71), G72 (= G72), T75 (≠ A75), N93 (= N93), T94 (≠ S94), P125 (= P125), N126 (= N126), C127 (= C127), G160 (= G160), M161 (≠ I161), G328 (= G317)

4r4jA Crystal structure of complex sp_asadh with 3-carboxypropyl-phthalic acid and nicotinamide adenine dinucleotide phosphate (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/359 of 4r4jA

query
sites
4r4jA

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-
x
S

A
|
A

G
|
G

G

S

S

S

A
x
T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G
|
G

A

A

G
|
G

I
x
M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E
|
E

E

E

W

M

K
|
K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H
|
H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G
|
G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

binding 3-(3-carboxypropyl)benzene-1,2-dicarboxylic acid: T94 (≠ S94), S95 (= S95), R98 (= R98), N126 (= N126), C127 (= C127), Q154 (= Q154), G158 (= G158), E219 (= E208), K222 (= K211), R244 (= R233), H251 (= H240)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (= A13), V13 (= V14), A35 (= A36), S36 (≠ T37), R38 (= R39), S39 (= S40), T56 (= T57), S70 (vs. gap), A71 (= A71), G72 (= G72), T75 (≠ A75), N93 (= N93), T94 (≠ S94), N126 (= N126), C127 (= C127), G160 (= G160), M161 (≠ I161), G328 (= G317)

3pyxB Crystals structure of aspartate beta-semialdehyde dehydrogenase complex with NADP and 2-aminoterephthalate (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/359 of 3pyxB

query
sites
3pyxB

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-
x
S

A
|
A

G
|
G

G

S

S

S

A
x
T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R
|
R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N

N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

A

A

V

V

S
|
S

G
|
G

A

A

G
|
G

I
x
M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E
|
E

E

E

W

M

K
|
K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H

H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q
x
N

L
|
L

R

L

K

K

G

G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

binding 2-aminobenzene-1,4-dicarboxylic acid: R98 (= R98), G158 (= G158), E219 (= E208), K222 (= K211), R244 (= R233)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (= A13), V13 (= V14), A35 (= A36), S36 (≠ T37), R38 (= R39), S39 (= S40), T56 (= T57), S70 (vs. gap), A71 (= A71), G72 (= G72), T75 (≠ A75), C127 (= C127), S157 (= S157), G158 (= G158), G160 (= G160), M161 (≠ I161), N324 (≠ Q313), L325 (= L314)

3q11A Crystals structure of aspartate beta-semialdehyde dehydrogenase from streptococcus pneumoniae with NADP and aspartyl beta- difluorophosphonate (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/358 of 3q11A

query
sites
3q11A

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A

A

V

V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-

S

A
|
A

G

G

G

S

S

S

A
x
T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R
|
R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G
|
G

A

A

G
|
G

I
x
M

E
x
G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E
|
E

E

E

W

M

K
|
K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H

H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G

G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A35 (= A36), S36 (≠ T37), R38 (= R39), S39 (= S40), T56 (= T57), A71 (= A71), T75 (≠ A75), G160 (= G160), M161 (≠ I161), G162 (≠ E162)
binding 5,5-difluoro-4-oxo-5-phosphono-D-norvaline: R98 (= R98), N126 (= N126), C127 (= C127), Q154 (= Q154), G158 (= G158), E219 (= E208), K222 (= K211), R244 (= R233)

4r51A Crystal complex structure of sp-aspartate-semialdehyde-dehydrogenase with nicotinamide adenine dinucleotide phosphate and phthalic acid (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/360 of 4r51A

query
sites
4r51A

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R

R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-
x
S

A
|
A

G
|
G

G
x
S

S

S

A

T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G

G

A

A

G
|
G

I
x
M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E

E

W

M

K
|
K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R

R

V

I

P

P

V

V

F

L

R

S

S

A

H

H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G
|
G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (= A13), V13 (= V14), A35 (= A36), S36 (≠ T37), S39 (= S40), T56 (= T57), S70 (vs. gap), A71 (= A71), G72 (= G72), N93 (= N93), T94 (≠ S94), N126 (= N126), C127 (= C127), G160 (= G160), M161 (≠ I161), G328 (= G317)
binding phthalic acid: S73 (≠ G73), T94 (≠ S94), S95 (= S95), R98 (= R98), N126 (= N126), K222 (= K211)

3pylC Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with d-2,3-diaminopropionate (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/361 of 3pylC

query
sites
3pylC

Y

Y

N

T

V

V

V

A

V

V

I

V

G

G

A

A

T

T

G

G

A

A

V

V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A

A

T

S

A

A

R

R

S

S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-

S

A

A

G

G

G

S

S

S

A

T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R

R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G
|
G

A

A

G

G

I

M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E
|
E

E

E

W

M

K

K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H

H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G

G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

binding 3-amino-D-alanine: N126 (= N126), C127 (= C127), G158 (= G158), E219 (= E208), R244 (= R233)

4r54A Complex crystal structure of sp-aspartate-semialdehyde-dehydrogenase with 3-carboxy-ethyl-phthalic acid (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/357 of 4r54A

query
sites
4r54A

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-
x
S

A
|
A

G
|
G

G
x
S

S

S

A
x
T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G

G

A

A

G
|
G

I

M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E

E

W

M

K
|
K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R

R

V

I

P

P

V

V

F

L

R

S

S

A

H

H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G
|
G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

binding 3-(2-carboxyethyl)benzene-1,2-dicarboxylic acid: G72 (= G72), S73 (≠ G73), T94 (≠ S94), S95 (= S95), R98 (= R98), K222 (= K211)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (= A13), V13 (= V14), A35 (= A36), S36 (≠ T37), R38 (= R39), S39 (= S40), T56 (= T57), S70 (vs. gap), A71 (= A71), G72 (= G72), T75 (≠ A75), N93 (= N93), T94 (≠ S94), N126 (= N126), C127 (= C127), G160 (= G160), G328 (= G317)

4r41A Complex crystal structure of 4-nitro-2-phosphono-benzoic acid with sp- aspartate-semialdehyde dehydrogenase and nicotinamide-dinucleotide (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/357 of 4r41A

query
sites
4r41A

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V

V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-
x
S

A
|
A

G
|
G

G
x
S

S

S

A

T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N

N

C

C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G

G

A

A

G
|
G

I
x
M

E
x
G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E

E

W

M

K
|
K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R

R

V

I

P

P

V

V

F

L

R

S

S

A

H

H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G

G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

binding 4-nitro-2-phosphonobenzoic acid: S70 (vs. gap), G72 (= G72), S73 (≠ G73), N93 (= N93), T94 (≠ S94), S95 (= S95), R98 (= R98), K222 (= K211)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (= A13), A35 (= A36), S36 (≠ T37), R38 (= R39), S39 (= S40), T56 (= T57), A71 (= A71), G160 (= G160), M161 (≠ I161), G162 (≠ E162)

4r3nA Crystal structure of the ternary complex of sp-asadh with NADP and 1, 2,3-benzenetricarboxylic acid (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/357 of 4r3nA

query
sites
4r3nA

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R

R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-
x
S

A
|
A

G
|
G

G
x
S

S

S

A

T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G

G

A

A

G
|
G

I
x
M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E

E

W

M

K
|
K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H
|
H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G
|
G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

active site: C127 (= C127), Q154 (= Q154), R244 (= R233), H251 (= H240)
binding benzene-1,2,3-tricarboxylic acid: S73 (≠ G73), T94 (≠ S94), S95 (= S95), R98 (= R98), N126 (= N126), K222 (= K211)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (= A13), V13 (= V14), A35 (= A36), S36 (≠ T37), S39 (= S40), T56 (= T57), S70 (vs. gap), A71 (= A71), G72 (= G72), N93 (= N93), T94 (≠ S94), N126 (= N126), C127 (= C127), G160 (= G160), M161 (≠ I161), G328 (= G317)

3q1lA Crystals structure of aspartate beta-semialdehyde dehydrogenase from streptococcus pneumoniae with cysteamine bound covalently to cys 128 (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/357 of 3q1lA

query
sites
3q1lA

Y

Y

N

T

V

V

V

A

V

V

I

V

G

G

A

A

T

T

G

G

A

A

V

V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A

A

T

S

A

A

R

R

S

S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-

S

A

A

G

G

G

S

S

S

A

T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R

R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G
|
G

A

A

G

G

I

M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E
|
E

E

E

W

M

K

K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H
|
H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G

G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

active site: C127 (= C127), Q154 (= Q154), R244 (= R233), H251 (= H240)
binding 2-amino-ethanethiol: N126 (= N126), C127 (= C127), G158 (= G158), E219 (= E208)

3pwsA Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with 2',5'-adenosine diphosphate and d-2- aminoadipate (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/357 of 3pwsA

query
sites
3pwsA

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V

V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-

S

A
|
A

G

G

G

S

S

S

A
x
T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R
|
R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N
|
N

C

C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G
|
G

A

A

G
|
G

I
x
M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I
|
I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E
|
E

E

E

W

M

K
|
K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H

H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G

G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

binding (2R)-2-aminohexanedioic acid: R98 (= R98), N126 (= N126), G158 (= G158), I208 (= I197), E219 (= E208), K222 (= K211), R244 (= R233)
binding adenosine-2'-5'-diphosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (= A13), A35 (= A36), S36 (≠ T37), R38 (= R39), S39 (= S40), T56 (= T57), A71 (= A71), T75 (≠ A75), G160 (= G160), M161 (≠ I161)

3pwkA Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with 2',5'-adenosine diphosphate and d-2- aminoadipate (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/357 of 3pwkA

query
sites
3pwkA

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V

V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-

S

A
|
A

G

G

G

S

S

S

A
x
T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R
|
R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N
|
N

C

C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G
|
G

A
|
A

G
|
G

I

M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E
|
E

E

E

W

M

K
|
K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H

H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G

G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

binding 5'-o-monophosphoryladenylyl(2'->5')adenylyl(2'->5')adenosine: G8 (= G9), T10 (= T11), G11 (= G12), A12 (= A13), A35 (= A36), S36 (≠ T37), R38 (= R39), S39 (= S40), T56 (= T57), A71 (= A71), T75 (≠ A75), G160 (= G160)
binding trans-cyclohexane-1,4-dicarboxylic acid: R98 (= R98), N126 (= N126), G158 (= G158), A159 (= A159), E219 (= E208), K222 (= K211), R244 (= R233)

2gz3A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with NADP and aspartate- semialdehyde (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/357 of 2gz3A

query
sites
2gz3A

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-
x
S

A
|
A

G
|
G

G

S

S

S

A
x
T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N
|
N

S

T

S

S

A

Y

F

F

R

R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N

N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G
|
G

A

A

G
|
G

I
x
M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E
|
E

E

E

W

M

K

K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H
|
H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q
x
N

L

L

R

L

K

K

G

G

A
|
A

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

active site: C127 (= C127), Q154 (= Q154), R244 (= R233), H251 (= H240)
binding (2r)-2-amino-4-oxobutanoic acid: C127 (= C127), Q154 (= Q154), G158 (= G158), E219 (= E208), R244 (= R233), H251 (= H240)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (= A13), V13 (= V14), A35 (= A36), S36 (≠ T37), R38 (= R39), S39 (= S40), T56 (= T57), S70 (vs. gap), A71 (= A71), G72 (= G72), T75 (≠ A75), N93 (= N93), G158 (= G158), G160 (= G160), M161 (≠ I161), N324 (≠ Q313), A329 (= A318)

2gz2A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with 2',5'-adp (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/357 of 2gz2A

query
sites
2gz2A

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A

A

V

V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-

S

A
|
A

G

G

G

S

S

S

A
x
T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R

R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N

N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G

G

A

A

G

G

I

M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E

E

W

M

K

K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H
|
H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q

N

L

L

R

L

K

K

G

G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

active site: C127 (= C127), Q154 (= Q154), R244 (= R233), H251 (= H240)
binding adenosine-2'-5'-diphosphate: G8 (= G9), T10 (= T11), G11 (= G12), A35 (= A36), S36 (≠ T37), R38 (= R39), S39 (= S40), T56 (= T57), A71 (= A71), T75 (≠ A75)

2gz1A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with NADP (see paper)
49% identity, 99% coverage: 3:336/339 of query aligns to 2:347/357 of 2gz1A

query
sites
2gz1A

Y

Y

N

T

V

V

V

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

G

A

E

Q

I

M

L

I

K

K

I

M

L

L

Q

E

E

E

R

S

S

T

F

L

P

P

V

I

N

D

K

K

L

I

R

R

L

Y

G

L

A
|
A

T
x
S

A

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

A

K

F

F

R

K

G

D

E

Q

I

D

Y

I

R

T

V

I

E

E

T
|
T

T

T

P

E

E

T

I

A

F

F

E

E

G

G

M

V

D

D

I

I

A

A

L

L

F

F

-
x
S

A
|
A

G
|
G

G

S

S

S

A
x
T

S

S

K

A

E

K

F

Y

A

A

R

P

I

Y

A

A

A

V

A

K

K

A

G

G

V

V

T

V

V

V

I

V

D

D

N
|
N

S

T

S

S

A

Y

F

F

R

R

L

Q

E

N

P

P

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

A

E

H

D

A

V

L

K

D

H

A

H

H

K

N

G

G

I

I

A

A

N

C

P

P

N

N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

V

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

Y

K

G

W

K

G

I

L

K

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S
|
S

G
|
G

A

A

G
|
G

I
x
M

E

G

A

A

I

I

E

L

E

E

L

T

K

Q

H

R

Q

E

V

L

Q

R

A

E

Y

V

L

L

N

N

G

-

E

D

E

G

V

V

E

K

P

P

-

C

-

D

-

L

-

H

-

A

K

E

V

I

F

L

P

P

-

S

-

G

-

D

-

K

-

H

Y

Y

P

P

I

I

A

A

F

F

N

N

L

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

D

D

L

N

Y

D

Y

Y

T

T

K

Y

E

E

W

M

K

K

M

M

V

T

F

K

E

E

T

T

Q

K

K

K

I

I

M

M

H

E

D

D

S

D

E

S

I

I

K

A

V

V

T

S

A

A

T

T

T

C

V

V

R
|
R

V

I

P

P

V

V

F

L

R

S

S

A

H
|
H

S

S

E

E

S

S

I

V

N

Y

I

I

E

E

T

T

K

K

V

E

K

V

I

A

T

P

R

I

E

E

K

E

A

V

I

K

E

A

L

A

L

I

S

A

N

A

A

F

P

P

G

G

I

A

R

V

V

L

V

E

D

D

N

D

P

V

E

A

E

H

K

Q

Q

I

Y

Y

P

P

M

Q

P

A

L

I

F

N

A

A

S

V

D

G

R

S

D

R

E

D

V

T

Y

F

V

V

G

G

R

R

I

I

R

R

E

K

D

D

N

L

T

D

I

A

S

E

N

K

G

G

L

I

N

H

L

M

W

W

V

V

A

S

D

D

Q
x
N

L
|
L

R

L

K

K

G

G

A

A

T

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

I

H

K

E

Y

R

G

G

C

L

V

V

K

R

active site: C127 (= C127), Q154 (= Q154), R244 (= R233), H251 (= H240)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (= A13), V13 (= V14), A35 (= A36), S36 (≠ T37), R38 (= R39), S39 (= S40), T56 (= T57), S70 (vs. gap), A71 (= A71), G72 (= G72), T75 (≠ A75), N93 (= N93), S157 (= S157), G158 (= G158), G160 (= G160), M161 (≠ I161), N324 (≠ Q313), L325 (= L314)

3tz6A Crystal structure of aspartate semialdehyde dehydrogenase complexed with inhibitor smcs (cys) and phosphate from mycobacterium tuberculosis h37rv (see paper)
46% identity, 96% coverage: 3:329/339 of query aligns to 2:340/342 of 3tz6A

query
sites
3tz6A

Y

L

N

S

V

I

V

G

V

I

I

V

G

G

A

A

T

T

G

G

A

Q

V

V

G

G

G

Q

E

V

I

M

L

R

K

T

I

L

L

L

Q

D

E

E

R

R

S

D

F

F

P

P

V

A

N

S

K

A

L

V

R

R

L

F

G

F

A

A

T

S

A

A

R

R

S

S

A

Q

G

G

K

R

E

K

V

L

A

A

F

F

R

R

G

G

E

Q

I

E

Y

I

R

E

V

V

E

E

E

D

T

A

T

E

P

T

E

A

I

D

F

P

E

S

G

G

M

L

D

D

I

I

A

A

L

L

F

F

A

S

G

A

G

G

S

S

A

A

-

M

S

S

K

K

E

V

F

Q

A

A

R

P

I

R

A

F

A

A

K

A

G

G

V

V

T

T

V

V

I

I

D

D

N

N

S

S

A

A

F

W

R
|
R

L

K

E

D

P

P

D

D

V

V

P

P

L

L

V

V

P
x
S

E

E

V

V

N

N

P

F

E

E

D

R

V

D

K

A

H
|
H

H

R

-
x
R

-

P

K

K

G

G

I

I

A

A

N

N

P

P

N
|
N

C
|
C

S

T

T

T

I

M

Q

A

M

A

V

M

V

P

A

V

L

L

K

K

P

V

L

L

H

H

D

D

Y

E

G

A

K

R

I

L

K

V

R

R

V

L

V

V

S

S

T

S

Y

Y

Q
|
Q

A

A

V

V

S

S

G
|
G

A

S

G

G

I

L

E

A

A

G

I

V

E

A

E

E

L

L

K

A

H

E

Q

Q

V

A

Q

R

A

A

Y

V

L

I

N

G

G

G

E

A

E

E

V

Q

-

L

-

V

-

Y

-

D

-
x
G

-

G

-

A

-

L

-

E

-
x
F

-

P

E

P

P

P

K

N

V

T

F

Y

P

V

Y

A

P
|
P

I

I

A

A

F

F

N

N

L

V

I

V

P

P

H

L

I

A

D

G

V

S

F

L

Q

V

D

D

-

D

-

G

L

S

Y

G

Y

E

T

T

K

D

E
|
E

E

D

W
x
Q

K
|
K

M

L

V
x
R

F
|
F

E

E

T

S

Q

R

K

K

I

I

M

L

H

G

D

I

S

P

E

D

I

L

K

L

V

V

T

S

A

G

T

T

T

C

V

V

R
|
R

V

V

P

P

V

V

F

F

R

T

S

G

H
|
H

S

S

E

L

S

S

I

I

N

N

I

A

E

E

T

F

K

A

V

Q

K

P

I

L

T

S

R

P

E
|
E

K

R

A

A

I
x
R

E

E

L

L

S

D

N

G

A

A

P

T

G

G

I

V

R

Q

V

L

V

V

D

D

N

-

P

-

E

-

K

-

Q

-

Y

V

P

P

M

T

P

P

L

L

F

A

A

A

S

A

D

G

R

V

D

D

E

E

V

S

Y

L

V

V

G

G

R

R

I

I

R

R

E

R

D

D

N

P

T

G

I

V

S

P

N

D

-

G

-

R

G

G

L

L

N

A

L

L

W

F

V

V

V

S

A

G

D

D

Q

N

L

L

R

R

K

K

G

G

A

A

T

L

N

N

A

T

V

I

Q
|
Q

I

I

A

A

E
|
E

L
|
L

L

L

active site: C129 (= C127), Q156 (= Q154), R248 (= R233), H255 (= H240)
binding cysteine: C129 (= C127), Q156 (= Q154), G160 (= G158), E223 (= E208), R248 (= R233), H255 (= H240)
binding glycerol: S108 (≠ P108), G187 (vs. gap), F192 (vs. gap), P201 (= P188), Q225 (≠ W210), R228 (≠ V213), F229 (= F214), Q335 (= Q324), E338 (= E327), L339 (= L328)
binding sulfate ion: R98 (= R98), H117 (= H117), R119 (vs. gap), N128 (= N126), C129 (= C127), K226 (= K211), E270 (= E255), R273 (≠ I258)

Query Sequence

>WP_075859551.1 NCBI__GCF_001950255.1:WP_075859551.1
MSYNVVVIGATGAVGGEILKILQERSFPVNKLRLGATARSAGKEVAFRGEIYRVEETTPE
IFEGMDIALFAGGSASKEFARIAAAKGVTVIDNSSAFRLEPDVPLVVPEVNPEDVKHHKG
IIANPNCSTIQMVVALKPLHDYGKIKRVVVSTYQAVSGAGIEAIEELKHQVQAYLNGEEV
EPKVFPYPIAFNLIPHIDVFQDLYYTKEEWKMVFETQKIMHDSEIKVTATTVRVPVFRSH
SESINIETKVKITREKAIELLSNAPGIRVVDNPEEKQYPMPLFASDRDEVYVGRIREDNT
ISNGLNLWVVADQLRKGAATNAVQIAELLIKYGCVKQNG

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