SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing WP_012506494.1 NCBI__GCF_000020625.1:WP_012506494.1 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)

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)
53% identity, 97% coverage: 8:336/339 of query aligns to 5:333/337 of P23247

query
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P23247

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C132 (= C137) active site, Acyl-thioester intermediate

2r00C Crystal structure of aspartate semialdehyde dehydrogenase ii complexed with asa from vibrio cholerae (see paper)
53% identity, 97% coverage: 8:336/339 of query aligns to 4:332/336 of 2r00C

query
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2r00C

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active site: C131 (= C137), Q158 (= Q164), R237 (= R239), H244 (= H246)
binding 2,2'-oxydiacetic acid: V15 (= V19), N95 (= N99), C131 (= C137), N315 (= N319)

Q04797 Aspartate-semialdehyde dehydrogenase; ASA dehydrogenase; ASADH; Aspartate-beta-semialdehyde dehydrogenase; EC 1.2.1.11 from Bacillus subtilis (strain 168) (see paper)
50% identity, 97% coverage: 6:335/339 of query aligns to 3:340/346 of Q04797

query
sites
Q04797

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S98 (= S101) modified: Phosphoserine
Y146 (= Y153) modified: Phosphotyrosine

3q11A Crystals structure of aspartate beta-semialdehyde dehydrogenase from streptococcus pneumoniae with NADP and aspartyl beta- difluorophosphonate (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/358 of 3q11A

query
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3q11A

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R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G14), T10 (= T16), G11 (= G17), A35 (= A41), S36 (= S42), R38 (= R44), S39 (= S45), T56 (≠ P62), A71 (= A77), T75 (≠ A81), G160 (= G170), M161 (≠ K171), G162 (≠ A172)
binding 5,5-difluoro-4-oxo-5-phosphono-D-norvaline: R98 (= R104), N126 (= N136), C127 (= C137), Q154 (= Q164), G158 (= G168), E219 (= E214), K222 (= K217), R244 (= R239)

4r5hA Crystal structure of sp-aspartate-semialdehyde-dehydrogenase with nicotinamide-adenine-dinucleotide-phosphate and 3-carboxy-propenyl- phthalic acid (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/359 of 4r5hA

query
sites
4r5hA

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L
x
A

V
|
V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R
|
R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

A
x
S

G

S

A
x
T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

T

S

G
|
G

K

A

G
|
G

K
x
M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

L

M

K
|
K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R
|
R

I

I

P

P

V

V

Y

L

G

S

G

A

H
|
H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

binding 3-[(1E)-3-carboxyprop-1-en-1-yl]benzene-1,2-dicarboxylic acid: S73 (≠ A79), T94 (≠ S100), S95 (= S101), R98 (= R104), N126 (= N136), C127 (= C137), Q154 (= Q164), G158 (= G168), K222 (= K217), R244 (= R239), H251 (= H246)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G14), T10 (= T16), G11 (= G17), A12 (≠ L18), V13 (= V19), A35 (= A41), S36 (= S42), R38 (= R44), S39 (= S45), T56 (≠ P62), S70 (= S76), A71 (= A77), G72 (= G78), T75 (≠ A81), N93 (= N99), T94 (≠ S100), P125 (= P135), N126 (= N136), C127 (= C137), G160 (= G170), M161 (≠ K171), G328 (= G323)

4r4jA Crystal structure of complex sp_asadh with 3-carboxypropyl-phthalic acid and nicotinamide adenine dinucleotide phosphate (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/359 of 4r4jA

query
sites
4r4jA

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L
x
A

V
|
V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R
|
R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

A

S

G

S

A
x
T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

T

S

G
|
G

K

A

G
|
G

K
x
M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

L

M

K
|
K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R
|
R

I

I

P

P

V

V

Y

L

G

S

G

A

H
|
H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

binding 3-(3-carboxypropyl)benzene-1,2-dicarboxylic acid: T94 (≠ S100), S95 (= S101), R98 (= R104), N126 (= N136), C127 (= C137), Q154 (= Q164), G158 (= G168), E219 (= E214), K222 (= K217), R244 (= R239), H251 (= H246)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G14), T10 (= T16), G11 (= G17), A12 (≠ L18), V13 (= V19), A35 (= A41), S36 (= S42), R38 (= R44), S39 (= S45), T56 (≠ P62), S70 (= S76), A71 (= A77), G72 (= G78), T75 (≠ A81), N93 (= N99), T94 (≠ S100), N126 (= N136), C127 (= C137), G160 (= G170), M161 (≠ K171), G328 (= G323)

3pyxB Crystals structure of aspartate beta-semialdehyde dehydrogenase complex with NADP and 2-aminoterephthalate (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/359 of 3pyxB

query
sites
3pyxB

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L
x
A

V
|
V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R
|
R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

A

S

G

S

A
x
T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R
|
R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

T
x
S

G
|
G

K

A

G
|
G

K
x
M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

L

M

K
|
K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R
|
R

I

I

P

P

V

V

Y

L

G

S

G

A

H

H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N
|
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

Q

T

L

L

I

H

G

E

R

R

binding 2-aminobenzene-1,4-dicarboxylic acid: R98 (= R104), G158 (= G168), E219 (= E214), K222 (= K217), R244 (= R239)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G14), T10 (= T16), G11 (= G17), A12 (≠ L18), V13 (= V19), A35 (= A41), S36 (= S42), R38 (= R44), S39 (= S45), T56 (≠ P62), S70 (= S76), A71 (= A77), G72 (= G78), T75 (≠ A81), C127 (= C137), S157 (≠ T167), G158 (= G168), G160 (= G170), M161 (≠ K171), N324 (= N319), L325 (= L320)

4r51A Crystal complex structure of sp-aspartate-semialdehyde-dehydrogenase with nicotinamide adenine dinucleotide phosphate and phthalic acid (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/360 of 4r51A

query
sites
4r51A

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L
x
A

V
|
V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R

R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

A
x
S

G

S

A

T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

T

S

G

G

K

A

G
|
G

K
x
M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

L

M

K
|
K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R

R

I

I

P

P

V

V

Y

L

G

S

G

A

H

H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G14), T10 (= T16), G11 (= G17), A12 (≠ L18), V13 (= V19), A35 (= A41), S36 (= S42), S39 (= S45), T56 (≠ P62), S70 (= S76), A71 (= A77), G72 (= G78), N93 (= N99), T94 (≠ S100), N126 (= N136), C127 (= C137), G160 (= G170), M161 (≠ K171), G328 (= G323)
binding phthalic acid: S73 (≠ A79), T94 (≠ S100), S95 (= S101), R98 (= R104), N126 (= N136), K222 (= K217)

4r54A Complex crystal structure of sp-aspartate-semialdehyde-dehydrogenase with 3-carboxy-ethyl-phthalic acid (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/357 of 4r54A

query
sites
4r54A

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L
x
A

V
|
V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R
|
R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

A
x
S

G

S

A
x
T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

T

S

G

G

K

A

G
|
G

K

M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

L

M

K
|
K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R

R

I

I

P

P

V

V

Y

L

G

S

G

A

H

H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

binding 3-(2-carboxyethyl)benzene-1,2-dicarboxylic acid: G72 (= G78), S73 (≠ A79), T94 (≠ S100), S95 (= S101), R98 (= R104), K222 (= K217)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G14), T10 (= T16), G11 (= G17), A12 (≠ L18), V13 (= V19), A35 (= A41), S36 (= S42), R38 (= R44), S39 (= S45), T56 (≠ P62), S70 (= S76), A71 (= A77), G72 (= G78), T75 (≠ A81), N93 (= N99), T94 (≠ S100), N126 (= N136), C127 (= C137), G160 (= G170), G328 (= G323)

4r41A Complex crystal structure of 4-nitro-2-phosphono-benzoic acid with sp- aspartate-semialdehyde dehydrogenase and nicotinamide-dinucleotide (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/357 of 4r41A

query
sites
4r41A

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L
x
A

V

V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R
|
R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

A
x
S

G

S

A

T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

T

S

G

G

K

A

G
|
G

K
x
M

A
x
G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

L

M

K
|
K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R

R

I

I

P

P

V

V

Y

L

G

S

G

A

H

H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

binding 4-nitro-2-phosphonobenzoic acid: S70 (= S76), G72 (= G78), S73 (≠ A79), N93 (= N99), T94 (≠ S100), S95 (= S101), R98 (= R104), K222 (= K217)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G14), T10 (= T16), G11 (= G17), A12 (≠ L18), A35 (= A41), S36 (= S42), R38 (= R44), S39 (= S45), T56 (≠ P62), A71 (= A77), G160 (= G170), M161 (≠ K171), G162 (≠ A172)

4r3nA Crystal structure of the ternary complex of sp-asadh with NADP and 1, 2,3-benzenetricarboxylic acid (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/357 of 4r3nA

query
sites
4r3nA

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L
x
A

V
|
V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R

R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

A
x
S

G

S

A

T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

S
x
T

S
|
S

A

Y

F

F

R
|
R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

T

S

G

G

K

A

G
|
G

K
x
M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

L

M

K
|
K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R
|
R

I

I

P

P

V

V

Y

L

G

S

G

A

H
|
H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

active site: C127 (= C137), Q154 (= Q164), R244 (= R239), H251 (= H246)
binding benzene-1,2,3-tricarboxylic acid: S73 (≠ A79), T94 (≠ S100), S95 (= S101), R98 (= R104), N126 (= N136), K222 (= K217)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G14), T10 (= T16), G11 (= G17), A12 (≠ L18), V13 (= V19), A35 (= A41), S36 (= S42), S39 (= S45), T56 (≠ P62), S70 (= S76), A71 (= A77), G72 (= G78), N93 (= N99), T94 (≠ S100), N126 (= N136), C127 (= C137), G160 (= G170), M161 (≠ K171), G328 (= G323)

3q1lA Crystals structure of aspartate beta-semialdehyde dehydrogenase from streptococcus pneumoniae with cysteamine bound covalently to cys 128 (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/357 of 3q1lA

query
sites
3q1lA

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G

G

A

A

T

T

G

G

L

A

V

V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A

A

S

S

S

A

R

R

S

S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P

T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S

S

A

A

G

G

A

S

G

S

A

T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R

R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

T

S

G
|
G

K

A

G

G

K

M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

L

M

K

K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R
|
R

I

I

P

P

V

V

Y

L

G

S

G

A

H
|
H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

active site: C127 (= C137), Q154 (= Q164), R244 (= R239), H251 (= H246)
binding 2-amino-ethanethiol: N126 (= N136), C127 (= C137), G158 (= G168), E219 (= E214)

3pwsA Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with 2',5'-adenosine diphosphate and d-2- aminoadipate (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/357 of 3pwsA

query
sites
3pwsA

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L
x
A

V

V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R
|
R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S

S

A
|
A

G

G

A

S

G

S

A
x
T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R
|
R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

T

S

G
|
G

K

A

G
|
G

K
x
M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I
|
I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

L

M

K
|
K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R
|
R

I

I

P

P

V

V

Y

L

G

S

G

A

H

H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

binding (2R)-2-aminohexanedioic acid: R98 (= R104), N126 (= N136), G158 (= G168), I208 (= I203), E219 (= E214), K222 (= K217), R244 (= R239)
binding adenosine-2'-5'-diphosphate: G8 (= G14), T10 (= T16), G11 (= G17), A12 (≠ L18), A35 (= A41), S36 (= S42), R38 (= R44), S39 (= S45), T56 (≠ P62), A71 (= A77), T75 (≠ A81), G160 (= G170), M161 (≠ K171)

3pwkA Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with 2',5'-adenosine diphosphate and d-2- aminoadipate (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/357 of 3pwkA

query
sites
3pwkA

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L
x
A

V

V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R
|
R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S

S

A
|
A

G

G

A

S

G

S

A
x
T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R
|
R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

T

S

G
|
G

K
x
A

G
|
G

K

M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

L

M

K
|
K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R
|
R

I

I

P

P

V

V

Y

L

G

S

G

A

H

H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

binding 5'-o-monophosphoryladenylyl(2'->5')adenylyl(2'->5')adenosine: G8 (= G14), T10 (= T16), G11 (= G17), A12 (≠ L18), A35 (= A41), S36 (= S42), R38 (= R44), S39 (= S45), T56 (≠ P62), A71 (= A77), T75 (≠ A81), G160 (= G170)
binding trans-cyclohexane-1,4-dicarboxylic acid: R98 (= R104), N126 (= N136), G158 (= G168), A159 (≠ K169), E219 (= E214), K222 (= K217), R244 (= R239)

2gz3A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with NADP and aspartate- semialdehyde (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/357 of 2gz3A

query
sites
2gz3A

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L
x
A

V
|
V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R
|
R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

A

S

G

S

A
x
T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

S

T

S

S

A

Y

F

F

R

R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

T

S

G
|
G

K

A

G
|
G

K
x
M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

L

M

K

K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R
|
R

I

I

P

P

V

V

Y

L

G

S

G

A

H
|
H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N
|
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

Q

T

L

L

I

H

G

E

R

R

active site: C127 (= C137), Q154 (= Q164), R244 (= R239), H251 (= H246)
binding (2r)-2-amino-4-oxobutanoic acid: C127 (= C137), Q154 (= Q164), G158 (= G168), E219 (= E214), R244 (= R239), H251 (= H246)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G14), T10 (= T16), G11 (= G17), A12 (≠ L18), V13 (= V19), A35 (= A41), S36 (= S42), R38 (= R44), S39 (= S45), T56 (≠ P62), S70 (= S76), A71 (= A77), G72 (= G78), T75 (≠ A81), N93 (= N99), G158 (= G168), G160 (= G170), M161 (≠ K171), N324 (= N319), A329 (= A324)

2gz2A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with 2',5'-adp (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/357 of 2gz2A

query
sites
2gz2A

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L

A

V

V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R
|
R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S

S

A
|
A

G

G

A

S

G

S

A
x
T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R

R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

T

S

G

G

K

A

G

G

K

M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

L

M

K

K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R
|
R

I

I

P

P

V

V

Y

L

G

S

G

A

H
|
H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

active site: C127 (= C137), Q154 (= Q164), R244 (= R239), H251 (= H246)
binding adenosine-2'-5'-diphosphate: G8 (= G14), T10 (= T16), G11 (= G17), A35 (= A41), S36 (= S42), R38 (= R44), S39 (= S45), T56 (≠ P62), A71 (= A77), T75 (≠ A81)

2gz1A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with NADP (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/357 of 2gz1A

query
sites
2gz1A

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

L
x
A

V
|
V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A
|
A

S
|
S

S

A

R
|
R

S
|
S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P
x
T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

A

S

G

S

A
x
T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

S

T

S

S

A

Y

F

F

R

R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

T
x
S

G
|
G

K

A

G
|
G

K
x
M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

L

M

K

K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R
|
R

I

I

P

P

V

V

Y

L

G

S

G

A

H
|
H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N
|
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

Q

T

L

L

I

H

G

E

R

R

active site: C127 (= C137), Q154 (= Q164), R244 (= R239), H251 (= H246)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G14), T10 (= T16), G11 (= G17), A12 (≠ L18), V13 (= V19), A35 (= A41), S36 (= S42), R38 (= R44), S39 (= S45), T56 (≠ P62), S70 (= S76), A71 (= A77), G72 (= G78), T75 (≠ A81), N93 (= N99), S157 (≠ T167), G158 (= G168), G160 (= G170), M161 (≠ K171), N324 (= N319), L325 (= L320)

3pylC Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with d-2,3-diaminopropionate (see paper)
47% identity, 98% coverage: 7:338/339 of query aligns to 1:343/361 of 3pylC

query
sites
3pylC

G

G

Y

Y

R

T

V

V

A

A

I

V

L

V

G

G

A

A

T

T

G

G

L

A

V

V

G

G

R

A

T

Q

M

M

L

I

D

K

V

M

L

L

E

E

R

S

K

T

F

L

P

P

V

I

S

D

E

K

I

I

V

R

P

Y

L

L

A

A

S

S

S

A

R

R

S

S

R

A

G

G

K

K

E

S

I

L

V

K

F

F

D

K

G

D

R

Q

T

D

F

I

V

T

T

I

R

E

E

E

P

T

S

T

K

E

E

T

V

A

F

F

A

E

E

G

V

V

D

D

I

I

A

A

L

L

F

F

S

S

A

A

G

G

A

S

G

S

A

T

S

S

H

A

E

K

W

Y

A

A

R

P

I

Y

A

A

A

V

E

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

S

T

S

S

A

Y

F

F

R

R

M

Q

D

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

A

A

I

L

F

D

D

A

E

H

D

N

G

G

R

-

P

-

E

-

M

-

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

V

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

Y

W

R

G

L

L

R

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

T

S

G
|
G

K

A

G

G

K

M

A

G

G

A

R

I

D

L

A

E

L

T

E

Q

A

R

E

E

L

L

-

R

-

E

-

V

-

L

-

N

-

D

-

G

-

V

-

K

-

P

-

C

-

D

-

L

-

H

A

A

G

E

T

I

V

L

P

P

E

S

S

G

F

G

T

D

H

K

V

K

H

H

Q

Y

-

P

I

I

A

A

F

F

N

N

A

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

L

M

K

K

M

M

V

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

G

E

D

D

S

S

L

I

S

A

V

V

S

S

P

A

T

T

T

C

V

V

R
|
R

I

I

P

P

V

V

Y

L

G

S

G

A

H

H

G

S

E

E

S

S

L

V

N

Y

I

I

E

E

F

T

E

K

E

E

D

V

F

A

S

P

V

I

D

E

V

V

R

K

E

A

L

A

L

I

S

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

Q

E

D

D

N

D

P

V

S

A

A

H

N

Q

L

I

Y

Y

P

P

M

Q

P

A

L

I

S

N

S

A

Y

V

E

G

K

S

D

R

E

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

R

K

D

D

L

L

W

D

H

A

P

E

K

K

T

G

L

I

N

H

M

M

W

W

V

V

A

S

D

D

N

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

Q

T

L

L

I

H

G

E

R

R

binding 3-amino-D-alanine: N126 (= N136), C127 (= C137), G158 (= G168), E219 (= E214), R244 (= R239)

8jusA Crystal structure of aspartate semialdehyde dehydrogenase from porphyromonas gingivalis complexed with 2',5'adenosine diphosphate
48% identity, 97% coverage: 9:338/339 of query aligns to 2:332/335 of 8jusA

query
sites
8jusA

R

K

V

I

A

A

I

I

L

V

G
|
G

A

V

T
x
S

G
|
G

L

A

V

V

G

G

R

Q

T

E

M

F

L

L

D

R

V

V

L

L

E

S

E

Q

R

R

K

D

F

F

P

P

V

I

S

D

E

G

I

L

V

Y

P

L

L

F

A
x
G

S
|
S

S

S

R
|
R

S
|
S

R

A

G

G

K

S

E

V

I

Y

V

S

F

F

D

K

G

G

R

K

T

E

F

Y

V

V

T

V

R

R

E

E

-

L

P

K

S

D

K

N

E

D

V

D

F

F

A

K

E

G

V

I

D

D

I

I

A

A

L

F

F

C

S
|
S

A
|
A

G

G

A

G

G

D

A
x
T

S

S

H

I

E

A

W

F

A

A

R

D

I

T

A

I

A

T

E

R

A

H

G

G

A

T

V

L

V

M

I

I

D

D

N

N

S

S

A

A

F

F

R

R

M

M

D

Q

P

E

D

D

V

V

P

P

L

L

V

V

P

P

E

E

V

V

N

N

P

G

E

D

A

-

I

-

F

-

D

D

E

A

D

L

G

V

R

H

P

P

E

R

M

N

I

I

A

S

N

N

P

P

N

N

C

C

S

T

T

T

I

I

Q

Q

M

M

V

V

V

A

L

L

K

K

P

P

L

I

H

E

D

D

R

L

Y

S

R

H

L

I

R

R

V

V

V

H

V

V

S

A

T

T

Y

Y

Q

Q

S

A

V

A

T

S

G

G

K

A

G

G

K

A

A

L

G

G

R

M

D

A

A

E

L

L

E

V

A

Q

-

Q

-

V

-

E

E

E

L

L

A

A

-

R

G

G

T

E

V

K

P

P

E

T

S

V

F

D

T

K

H

F

V

A

H

Y

Q

Q

I

L

A

M

F

Y

N

N

A

L

I

I

P

P

H

Q

I

I

D

D

V

V

F

F

Q

T

E

D

N

N

G

D

Y

Y

T

T

K

K

E

E

L

M

K

K

M

M

V

Y

N

R

E

E

T

T

R

K

K

R

I

I

M

M

G

H

D

S

D

D

S

V

L

M

S

-

V

V

S

S

P

A

T

T

T

C

V

V

R

R

I

V

P

P

V

V

Y

M

G

R

G

A

H

H

G

S

E

E

S

A

L

I

N

W

I

V

E

E

F

T

E

E

E

R

D

P

F

I

S

A

V

P

D

E

V

A

R

R

E

A

L

A

L

F

S

A

K

K

A

A

P

P

G

G

V

V

I

L

V

L

Q

C

D

D

N

E

P

P

S

S

A

E

N

K

L

Q

Y

Y

P

P

M

M

P

P

L

L

S

F

S

G

Y

T

E

E

K

Q

D

D

E

P

V

V

F

I

V

V

G

G

R

R

I

I

R

R

R

Q

D

D

L

L

W

A

H

N

P

P

K

N

T

G

L

L

N

V

M

F

W

W

V

C

V

V

A

S

D

D

N

Q

L

I

R

R

K

K

G

G

A

A

T

L

N

N

A

A

V

V

Q

Q

I

I

A

A

E

E

Q

Y

L

L

I

I

G

A

R

K

binding adenosine-2'-5'-diphosphate: G7 (= G14), S9 (≠ T16), G10 (= G17), G34 (≠ A41), S35 (= S42), R37 (= R44), S38 (= S45), S70 (= S76), A71 (= A77), T75 (≠ A81)

3tz6A Crystal structure of aspartate semialdehyde dehydrogenase complexed with inhibitor smcs (cys) and phosphate from mycobacterium tuberculosis h37rv (see paper)
46% identity, 97% coverage: 7:335/339 of query aligns to 1:340/342 of 3tz6A

query
sites
3tz6A

G

G

Y

L

R

S

V

I

A

G

I

I

L

V

G

G

A

A

T

T

G

G

L

Q

V

V

G

G

R

Q

T

V

M

M

L

R

D

T

V

L

L

L

E

D

E

E

R

R

K

D

F

F

P

P

V

A

S

S

E

A

I

V

V

R

P

F

L

F

A

A

S

S

S

A

R

R

S

S

R

Q

G

G

K

R

E

K

I

L

V

A

F

F

D

R

G

G

R

Q

T

E

F

I

V

E

T

V

R

E

E

D

P

A

S

E

K

T

E

A

V

D

F

P

A

S

E

G

V

L

D

D

I

I

A

A

L

L

F

F

S

S

A

A

G

G

A

S

G

A

A

M

S

S

H

K

E

V

W

Q

A

A

R

P

I

R

A

F

A

A

E

A

A

A

G

G

A

V

V

T

V

V

I

I

D

D

N

N

S

S

A

A

F

W

R
|
R

M

K

D

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

A

R

I

-

F

-

D

D

E

A

D
x
H

G

R

R
|
R

P

P

E

K

M

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

V

V

L

L

K

K

P

V

L

L

H

H

D

D

R

E

Y

A

R

R

L

L

R

V

R

R

V

L

V

V

S

S

T

S

Y

Y

Q
|
Q

S

A

V

V

T

S

G
|
G

K

S

G

G

K

L

A

A

G

G

R

V

D

A

A

E

L

L

E

-

A

A

E

E

L

Q

A

A

G

R

T

A

V

V

-

I

-

G

-

A

-

E

-

Q

-

L

-

V

-

Y

-

D

-
x
G

-

G

-

A

-

L

-

E

-
x
F

P

P

E

P

S

P

F

N

T

T

H

Y

V

V

H

A

Q
x
P

I

I

A

A

F

F

N

N

A

V

I

V

P

P

H

L

I

A

D

G

V

S

F

L

Q

V

E

D

N

D

G

G

Y

S

-

G

-

E

T

T

K

D

E
|
E

E

D

L
x
Q

K
|
K

M

L

V
x
R

N
x
F

E

E

T

S

R

R

K

K

I

I

M

L

G

G

D

I

D

P

S

D

L

L

S

L

V

V

S

S

P

G

T

T

T

C

V

V

R
|
R

I

V

P

P

V

V

Y

F

G

T

G

G

H
|
H

G

S

E

L

S

S

L

I

N

N

I

A

E

E

F

F

E

A

E

Q

D

P

F

L

S

S

V

P

D
x
E

D

R

V

A

R
|
R

E

E

L

L

S

D

K

G

A

A

P

T

G

G

V

V

I

Q

V

L

Q

V

D

D

N

-

P

-

S

-

A

-

N

-

L

-

Y

V

P

P

M

T

P

P

L

L

S

A

Y

A

E

G

K

V

D

D

E

E

V

S

F

L

V

V

G

G

R

R

I

I

R

R

D

D

L

P

W

G

H

V

P

P

-

D

-

G

K

R

T

G

L

L

N

A

M

L

W

F

V

V

V

S

A

G

D

D

N

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

Q
x
L

L

L

active site: C129 (= C137), Q156 (= Q164), R248 (= R239), H255 (= H246)
binding cysteine: C129 (= C137), Q156 (= Q164), G160 (= G168), E223 (= E214), R248 (= R239), H255 (= H246)
binding glycerol: S108 (≠ P114), G187 (vs. gap), F192 (vs. gap), P201 (≠ Q194), Q225 (≠ L216), R228 (≠ V219), F229 (≠ N220), Q335 (= Q330), E338 (= E333), L339 (≠ Q334)
binding sulfate ion: R98 (= R104), H117 (≠ D125), R119 (= R127), N128 (= N136), C129 (= C137), K226 (= K217), E270 (≠ D261), R273 (= R264)

Query Sequence

>WP_012506494.1 NCBI__GCF_000020625.1:WP_012506494.1
MSSTQKGYRVAILGATGLVGRTMLDVLEERKFPVSEIVPLASSRSRGKEIVFDGRTFVTR
EPSKEVFAEVDIALFSAGAGASHEWARIAAEAGAVVIDNSSAFRMDPDVPLVVPEVNPEA
IFDEDGRPEMIIANPNCSTIQMVVVLKPLHDRYRLRRVVVSTYQSVTGKGKAGRDALEAE
LAGTVPESFTHVHQIAFNAIPHIDVFQENGYTKEELKMVNETRKIMGDDSLSVSPTTVRI
PVYGGHGESLNIEFEEDFSVDDVRELLSKAPGVIVQDNPSANLYPMPLSSYEKDEVFVGR
IRRDLWHPKTLNMWVVADNLRKGAATNAVQIAEQLIGRL

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