SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing WP_012674944.1 NCBI__GCF_000021545.1:WP_012674944.1 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)
54% identity, 100% coverage: 2:337/337 of query aligns to 3:346/346 of Q04797

query
sites
Q04797

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S98 (= S97) modified: Phosphoserine
Y146 (≠ K145) modified: Phosphotyrosine

2r00C Crystal structure of aspartate semialdehyde dehydrogenase ii complexed with asa from vibrio cholerae (see paper)
54% identity, 99% coverage: 2:333/337 of query aligns to 2:333/336 of 2r00C

query
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2r00C

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active site: C131 (= C129), Q158 (= Q156), R237 (= R235), H244 (= H242)
binding 2,2'-oxydiacetic acid: V15 (= V15), N95 (= N95), C131 (= C129), N315 (= N315)

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)
54% identity, 99% coverage: 2:333/337 of query aligns to 3:334/337 of P23247

query
sites
P23247

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C132 (= C129) active site, Acyl-thioester intermediate

3q11A Crystals structure of aspartate beta-semialdehyde dehydrogenase from streptococcus pneumoniae with NADP and aspartyl beta- difluorophosphonate (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/358 of 3q11A

query
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3q11A

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A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G10), T10 (= T12), G11 (= G13), A35 (= A37), S36 (= S38), R38 (= R40), S39 (= S41), T56 (≠ V58), A71 (= A73), T75 (≠ R77), G160 (= G162), M161 (≠ A163), G162 (≠ T164)
binding 5,5-difluoro-4-oxo-5-phosphono-D-norvaline: R98 (= R100), N126 (= N128), C127 (= C129), Q154 (= Q156), G158 (= G160), E219 (= E210), K222 (= K213), R244 (= R235)

4r5hA Crystal structure of sp-aspartate-semialdehyde-dehydrogenase with nicotinamide-adenine-dinucleotide-phosphate and 3-carboxy-propenyl- phthalic acid (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/359 of 4r5hA

query
sites
4r5hA

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

G
x
S

E

S

R
x
T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G
|
G

A

A

G
|
G

A
x
M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

M

M

K
|
K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R
|
R

V

I

P

P

V

V

Y

L

V

S

G

A

H
|
H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

binding 3-[(1E)-3-carboxyprop-1-en-1-yl]benzene-1,2-dicarboxylic acid: S73 (≠ G75), T94 (≠ S96), S95 (= S97), R98 (= R100), N126 (= N128), C127 (= C129), Q154 (= Q156), G158 (= G160), K222 (= K213), R244 (= R235), H251 (= H242)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G10), T10 (= T12), G11 (= G13), A12 (= A14), V13 (= V15), A35 (= A37), S36 (= S38), R38 (= R40), S39 (= S41), T56 (≠ V58), S70 (= S72), A71 (= A73), G72 (= G74), T75 (≠ R77), N93 (= N95), T94 (≠ S96), P125 (= P127), N126 (= N128), C127 (= C129), G160 (= G162), M161 (≠ A163), G328 (= G319)

4r4jA Crystal structure of complex sp_asadh with 3-carboxypropyl-phthalic acid and nicotinamide adenine dinucleotide phosphate (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/359 of 4r4jA

query
sites
4r4jA

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

G

S

E

S

R
x
T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G
|
G

A

A

G
|
G

A
x
M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

M

M

K
|
K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R
|
R

V

I

P

P

V

V

Y

L

V

S

G

A

H
|
H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

binding 3-(3-carboxypropyl)benzene-1,2-dicarboxylic acid: T94 (≠ S96), S95 (= S97), R98 (= R100), N126 (= N128), C127 (= C129), Q154 (= Q156), G158 (= G160), E219 (= E210), K222 (= K213), R244 (= R235), H251 (= H242)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G10), T10 (= T12), G11 (= G13), A12 (= A14), V13 (= V15), A35 (= A37), S36 (= S38), R38 (= R40), S39 (= S41), T56 (≠ V58), S70 (= S72), A71 (= A73), G72 (= G74), T75 (≠ R77), N93 (= N95), T94 (≠ S96), N126 (= N128), C127 (= C129), G160 (= G162), M161 (≠ A163), G328 (= G319)

3pyxB Crystals structure of aspartate beta-semialdehyde dehydrogenase complex with NADP and 2-aminoterephthalate (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/359 of 3pyxB

query
sites
3pyxB

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

G

S

E

S

R
x
T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q

Q

A

A

V

V

S
|
S

G
|
G

A

A

G
|
G

A
x
M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

M

M

K
|
K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R
|
R

V

I

P

P

V

V

Y

L

V

S

G

A

H

H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

binding 2-aminobenzene-1,4-dicarboxylic acid: R98 (= R100), G158 (= G160), E219 (= E210), K222 (= K213), R244 (= R235)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G10), T10 (= T12), G11 (= G13), A12 (= A14), V13 (= V15), A35 (= A37), S36 (= S38), R38 (= R40), S39 (= S41), T56 (≠ V58), S70 (= S72), A71 (= A73), G72 (= G74), T75 (≠ R77), C127 (= C129), S157 (= S159), G158 (= G160), G160 (= G162), M161 (≠ A163), N324 (= N315), L325 (= L316)

4r51A Crystal complex structure of sp-aspartate-semialdehyde-dehydrogenase with nicotinamide adenine dinucleotide phosphate and phthalic acid (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/360 of 4r51A

query
sites
4r51A

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R

R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

G
x
S

E

S

R

T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G

G

A

A

G
|
G

A
x
M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

M

M

K
|
K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R

R

V

I

P

P

V

V

Y

L

V

S

G

A

H

H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G10), T10 (= T12), G11 (= G13), A12 (= A14), V13 (= V15), A35 (= A37), S36 (= S38), S39 (= S41), T56 (≠ V58), S70 (= S72), A71 (= A73), G72 (= G74), N93 (= N95), T94 (≠ S96), N126 (= N128), C127 (= C129), G160 (= G162), M161 (≠ A163), G328 (= G319)
binding phthalic acid: S73 (≠ G75), T94 (≠ S96), S95 (= S97), R98 (= R100), N126 (= N128), K222 (= K213)

3pylC Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with d-2,3-diaminopropionate (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/361 of 3pylC

query
sites
3pylC

Y

Y

N

T

V

V

A

A

I

V

L

V

G

G

A

A

T

T

G

G

A

A

V

V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A

A

S

S

E

A

R

R

S

S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V

T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S

S

A

A

G

G

G

S

E

S

R

T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G
|
G

A

A

G

G

A

M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

M

M

K

K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R
|
R

V

I

P

P

V

V

Y

L

V

S

G

A

H

H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

binding 3-amino-D-alanine: N126 (= N128), C127 (= C129), G158 (= G160), E219 (= E210), R244 (= R235)

4r54A Complex crystal structure of sp-aspartate-semialdehyde-dehydrogenase with 3-carboxy-ethyl-phthalic acid (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/357 of 4r54A

query
sites
4r54A

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

G
x
S

E

S

R
x
T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G

G

A

A

G
|
G

A

M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

M

M

K
|
K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R

R

V

I

P

P

V

V

Y

L

V

S

G

A

H

H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

binding 3-(2-carboxyethyl)benzene-1,2-dicarboxylic acid: G72 (= G74), S73 (≠ G75), T94 (≠ S96), S95 (= S97), R98 (= R100), K222 (= K213)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G10), T10 (= T12), G11 (= G13), A12 (= A14), V13 (= V15), A35 (= A37), S36 (= S38), R38 (= R40), S39 (= S41), T56 (≠ V58), S70 (= S72), A71 (= A73), G72 (= G74), T75 (≠ R77), N93 (= N95), T94 (≠ S96), N126 (= N128), C127 (= C129), G160 (= G162), G328 (= G319)

4r41A Complex crystal structure of 4-nitro-2-phosphono-benzoic acid with sp- aspartate-semialdehyde dehydrogenase and nicotinamide-dinucleotide (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/357 of 4r41A

query
sites
4r41A

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V

V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

G
x
S

E

S

R

T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G

G

A

A

G
|
G

A
x
M

T
x
G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

M

M

K
|
K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R

R

V

I

P

P

V

V

Y

L

V

S

G

A

H

H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

binding 4-nitro-2-phosphonobenzoic acid: S70 (= S72), G72 (= G74), S73 (≠ G75), N93 (= N95), T94 (≠ S96), S95 (= S97), R98 (= R100), K222 (= K213)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G10), T10 (= T12), G11 (= G13), A12 (= A14), A35 (= A37), S36 (= S38), R38 (= R40), S39 (= S41), T56 (≠ V58), A71 (= A73), G160 (= G162), M161 (≠ A163), G162 (≠ T164)

4r3nA Crystal structure of the ternary complex of sp-asadh with NADP and 1, 2,3-benzenetricarboxylic acid (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/357 of 4r3nA

query
sites
4r3nA

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R

R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

G
x
S

E

S

R

T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G

G

A

A

G
|
G

A
x
M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

M

M

K
|
K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R
|
R

V

I

P

P

V

V

Y

L

V

S

G

A

H
|
H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

active site: C127 (= C129), Q154 (= Q156), R244 (= R235), H251 (= H242)
binding benzene-1,2,3-tricarboxylic acid: S73 (≠ G75), T94 (≠ S96), S95 (= S97), R98 (= R100), N126 (= N128), K222 (= K213)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G10), T10 (= T12), G11 (= G13), A12 (= A14), V13 (= V15), A35 (= A37), S36 (= S38), S39 (= S41), T56 (≠ V58), S70 (= S72), A71 (= A73), G72 (= G74), N93 (= N95), T94 (≠ S96), N126 (= N128), C127 (= C129), G160 (= G162), M161 (≠ A163), G328 (= G319)

3q1lA Crystals structure of aspartate beta-semialdehyde dehydrogenase from streptococcus pneumoniae with cysteamine bound covalently to cys 128 (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/357 of 3q1lA

query
sites
3q1lA

Y

Y

N

T

V

V

A

A

I

V

L

V

G

G

A

A

T

T

G

G

A

A

V

V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A

A

S

S

E

A

R

R

S

S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V

T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S

S

A

A

G

G

G

S

E

S

R

T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G
|
G

A

A

G

G

A

M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

M

M

K

K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R
|
R

V

I

P

P

V

V

Y

L

V

S

G

A

H
|
H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

active site: C127 (= C129), Q154 (= Q156), R244 (= R235), H251 (= H242)
binding 2-amino-ethanethiol: N126 (= N128), C127 (= C129), G158 (= G160), E219 (= E210)

3pwsA Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with 2',5'-adenosine diphosphate and d-2- aminoadipate (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/357 of 3pwsA

query
sites
3pwsA

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V

V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S

S

A
|
A

G

G

G

S

E

S

R
x
T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G
|
G

A

A

G
|
G

A
x
M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I
|
I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

M

M

K
|
K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R
|
R

V

I

P

P

V

V

Y

L

V

S

G

A

H

H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

binding (2R)-2-aminohexanedioic acid: R98 (= R100), N126 (= N128), G158 (= G160), I208 (= I199), E219 (= E210), K222 (= K213), R244 (= R235)
binding adenosine-2'-5'-diphosphate: G8 (= G10), T10 (= T12), G11 (= G13), A12 (= A14), A35 (= A37), S36 (= S38), R38 (= R40), S39 (= S41), T56 (≠ V58), A71 (= A73), T75 (≠ R77), G160 (= G162), M161 (≠ A163)

3pwkA Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with 2',5'-adenosine diphosphate and d-2- aminoadipate (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/357 of 3pwkA

query
sites
3pwkA

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V

V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S

S

A
|
A

G

G

G

S

E

S

R
x
T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q

Q

A

A

V

V

S

S

G
|
G

A
|
A

G
|
G

A

M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

M

M

K
|
K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R
|
R

V

I

P

P

V

V

Y

L

V

S

G

A

H

H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

binding 5'-o-monophosphoryladenylyl(2'->5')adenylyl(2'->5')adenosine: G8 (= G10), T10 (= T12), G11 (= G13), A12 (= A14), A35 (= A37), S36 (= S38), R38 (= R40), S39 (= S41), T56 (≠ V58), A71 (= A73), T75 (≠ R77), G160 (= G162)
binding trans-cyclohexane-1,4-dicarboxylic acid: R98 (= R100), N126 (= N128), G158 (= G160), A159 (= A161), E219 (= E210), K222 (= K213), R244 (= R235)

2gz3A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with NADP and aspartate- semialdehyde (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/357 of 2gz3A

query
sites
2gz3A

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

G

S

E

S

R
x
T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G
|
G

A

A

G
|
G

A
x
M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E
|
E

E

E

M

M

K

K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R
|
R

V

I

P

P

V

V

Y

L

V

S

G

A

H
|
H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

active site: C127 (= C129), Q154 (= Q156), R244 (= R235), H251 (= H242)
binding (2r)-2-amino-4-oxobutanoic acid: C127 (= C129), Q154 (= Q156), G158 (= G160), E219 (= E210), R244 (= R235), H251 (= H242)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G10), T10 (= T12), G11 (= G13), A12 (= A14), V13 (= V15), A35 (= A37), S36 (= S38), R38 (= R40), S39 (= S41), T56 (≠ V58), S70 (= S72), A71 (= A73), G72 (= G74), T75 (≠ R77), N93 (= N95), G158 (= G160), G160 (= G162), M161 (≠ A163), N324 (= N315), A329 (= A320)

2gz2A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with 2',5'-adp (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/357 of 2gz2A

query
sites
2gz2A

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A

A

V

V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S

S

A
|
A

G

G

G

S

E

S

R
x
T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S

S

G

G

A

A

G

G

A

M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

M

M

K

K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R
|
R

V

I

P

P

V

V

Y

L

V

S

G

A

H
|
H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

active site: C127 (= C129), Q154 (= Q156), R244 (= R235), H251 (= H242)
binding adenosine-2'-5'-diphosphate: G8 (= G10), T10 (= T12), G11 (= G13), A35 (= A37), S36 (= S38), R38 (= R40), S39 (= S41), T56 (≠ V58), A71 (= A73), T75 (≠ R77)

2gz1A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with NADP (see paper)
52% identity, 99% coverage: 4:337/337 of query aligns to 2:346/357 of 2gz1A

query
sites
2gz1A

Y

Y

N

T

V

V

A

A

I

V

L

V

G
|
G

A

A

T
|
T

G
|
G

A
|
A

V
|
V

G

G

Q

A

T

Q

M

M

I

I

K

K

V

M

L

L

E

E

R

S

N

T

F

L

P

P

I

I

N

D

E

K

I

I

R

R

F

Y

L

L

A
|
A

S
|
S

E

A

R
|
R

S
|
S

A

A

G

G

K

K

E

S

V

L

E

K

Y

F

M

K

G

D

V

Q

K

D

Y

I

K

T

V

I

E

E

A

E

V
x
T

S

T

E

E

D

T

S

A

F

F

K

E

G

G

I

V

D

D

I

I

A

A

L

L

F

F

S
|
S

A
|
A

G
|
G

G

S

E

S

R
x
T

S

S

K

A

K

K

W

Y

A

A

P

P

I

Y

A

A

A

V

S

K

K

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

D

A

V

L

K

D

W

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

Y

E

P

P

I

V

H

R

K

Q

V

K

K

W

K

G

I

L

K

D

R

R

I

I

V

V

A

S

T

T

Y

Y

Q
|
Q

A

A

V

V

S
|
S

G
|
G

A

A

G
|
G

A
x
M

T

G

A

A

I

I

A

L

D

E

L

T

E

Q

N

R

E

E

T

L

K

R

A

E

V

V

M

L

E

N

G

D

R

G

Y

V

-

K

-

P

-

C

-

D

Y

L

Y

H

P

A

Q

E

A

I

L

L

P

P

-

S

-

G

-

D

-

K

H

H

H

Y

-

P

I

I

A

A

F

F

N

N

V

A

I

L

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

Y

E

E

M

M

K

K

M

M

I

T

N

K

E

E

T

T

R

K

K

K

I

I

M

M

H

E

E

D

P

D

D

S

I

I

K

A

V

V

S

S

P

A

T

T

C

C

V

V

R
|
R

V

I

P

P

V

V

Y

L

V

S

G

A

H
|
H

S

S

E

E

A

S

V

V

T

Y

I

I

E

E

T

T

Q

K

L

E

P

V

I

A

T

P

A

I

E

E

A

V

R

K

E

A

I

A

L

I

M

A

K

A

A

F

P

P

G

G

V

A

I

V

V

L

E

E

D

D

P

V

I

A

N

H

N

Q

V

I

Y

Y

P

P

V

Q

P

A

I

I

E

N

V

A

A

V

G

G

K

S

D

R

D

D

V

T

F

F

V

V

G

G

R

R

I

I

R

R

K

K

D

D

A

L

G

D

F

A

E

E

N

K

G

G

L

I

S

H

M

M

W

W

I

V

V

V

G

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

L

T

L

L

I

H

K

E

Y

R

E

G

L

L

I

V

active site: C127 (= C129), Q154 (= Q156), R244 (= R235), H251 (= H242)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G10), T10 (= T12), G11 (= G13), A12 (= A14), V13 (= V15), A35 (= A37), S36 (= S38), R38 (= R40), S39 (= S41), T56 (≠ V58), S70 (= S72), A71 (= A73), G72 (= G74), T75 (≠ R77), N93 (= N95), S157 (= S159), G158 (= G160), G160 (= G162), M161 (≠ A163), N324 (= N315), L325 (= L316)

8jusA Crystal structure of aspartate semialdehyde dehydrogenase from porphyromonas gingivalis complexed with 2',5'adenosine diphosphate
52% identity, 97% coverage: 6:332/337 of query aligns to 3:330/335 of 8jusA

query
sites
8jusA

V

I

A

A

I

I

L

V

G
|
G

A

V

T
x
S

G
|
G

A

A

V

V

G

G

Q

Q

T

E

M

F

I

L

K

R

V

V

L

L

E

S

E

Q

R

R

N

D

F

F

P

P

I

I

N

D

E

G

I

L

R

Y

F

L

L

F

A
x
G

S
|
S

E

S

R
|
R

S
|
S

A

A

G

G

K

S

E

V

V

Y

E

S

Y

F

M

K

G

G

V

K

K

E

Y

Y

K

V

V

V

E

R

A

E

V

L

S

K

E

D

-

N

D

D

S

D

F

F

K

K

G

G

I

I

D

D

I

I

A

A

L

F

F

C

S
|
S

A
|
A

G

G

E

D

R
x
T

S

S

K

I

K

A

W

F

A

A

P

D

I

T

A

I

A

T

S

R

K

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

D

D

V

A

K

L

W

V

H

H

-

P

K

R

G

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

A

A

L

L

Y

K

P

P

I

I

H

E

K

D

V

L

K

S

K

H

I

I

K

R

R

R

I

V

I

H

V

V

A

A

T

T

Y

Y

Q

Q

A

A

V

A

S

S

G

G

A

A

G

G

A

A

T

L

A

G

I

M

A

A

D

E

L

L

E

V

N

Q

E

Q

T

V

K

E

A

E

V

L

M

A

E

R

G

G

R

E

Y

K

Y

P

Y

T

P

V

Q

D

A

K

L

F

P

A

H

Y

H

Q

I

L

A

M

F

Y

N

N

V

L

I

I

P

P

R

Q

I

I

D

D

N

V

F

F

E

T

P

D

N

N

G

D

Y

Y

T

T

K

K

E

E

M

M

K

K

M

M

I

Y

N

R

E

E

T

T

R

K

K

R

I

I

M

M

H

H

E

S

P

-

D

D

I

V

K

M

V

V

S

S

P

A

T

T

C

C

V

V

R

R

V

V

P

P

V

V

Y

M

V

R

G

A

H

H

S

S

E

E

A

A

V

I

T

W

I

V

E

E

T

T

Q

E

L

R

P

P

I

I

T

A

A

P

E

E

A

A

R

R

E

A

I

A

L

F

M

A

K

K

A

A

P

P

G

G

V

V

I

L

V

L

E

C

D

D

D

E

P

P

I

S

N

E

N

K

V

Q

Y

Y

P

P

V

M

P

P

I

L

E

F

V

G

A

T

G

E

K

Q

D

D

D

P

V

V

F

I

V

V

G

G

R

R

I

I

R

R

K

Q

D

D

A

L

G

A

F

N

E

P

N

N

G

G

L

L

S

V

M

F

W

W

I

C

V

V

G

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

L

Y

L

L

I

I

binding adenosine-2'-5'-diphosphate: G7 (= G10), S9 (≠ T12), G10 (= G13), G34 (≠ A37), S35 (= S38), R37 (= R40), S38 (= S41), S70 (= S72), A71 (= A73), T75 (≠ R77)

3tz6A Crystal structure of aspartate semialdehyde dehydrogenase complexed with inhibitor smcs (cys) and phosphate from mycobacterium tuberculosis h37rv (see paper)
45% identity, 97% coverage: 4:331/337 of query aligns to 2:340/342 of 3tz6A

query
sites
3tz6A

Y

L

N

S

V

I

A

G

I

I

L

V

G

G

A

A

T

T

G

G

A

Q

V

V

G

G

Q

Q

T

V

M

M

I

R

K

T

V

L

L

L

E

D

E

E

R

R

N

D

F

F

P

P

I

A

N

S

E

A

I

V

R

R

F

F

L

F

A

A

S

S

E

A

R

R

S

S

A

Q

G

G

K

R

E

K

V

L

E

A

Y

F

M

R

G

G

V

Q

K

E

Y

I

K

E

V

V

E

E

A

D

V

A

S

E

E

T

D

A

S

D

F

P

K

S

G

G

I

L

D

D

I

I

A

A

L

L

F

F

S

S

A

A

G

G

G

S

E

A

R

M

S

S

K

K

K

V

W

Q

A

A

P

P

I

R

A

F

A

A

S

A

K

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

-

R

D

D

V

A

-
x
H

K

R

W
x
R

H

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

Y

K

P

V

I

L

H

H

K

D

V

E

K

A

K

R

I

L

K

V

R

R

I

L

I

V

V

V

A

S

T

S

Y

Y

Q
|
Q

A

A

V

V

S

S

G
|
G

A

S

G

G

A

L

T

A

A

G

I

V

A

A

D

E

L

L

E

A

N

E

E

Q

T

A

K

R

A

A

V

V

M

I

E

G

G

G

-

A

-

E

-

Q

-

L

-

V

-

Y

-

D

-
x
G

-

G

-

A

-

L

R

E

Y
x
F

Y

P

P

P

Q

N

A

T

L

Y

P

V

H

A

H
x
P

I

I

A

A

F

F

N

N

V

V

I

V

P

P

R

L

I

A

D

G

N

S

F

L

-

V

-

D

E

D

P

G

N

S

G

G

Y

E

T

T

K

D

E
|
E

E

D

M
x
Q

K
|
K

M

L

I
x
R

N
x
F

E

E

T

S

R

R

K

K

I

I

M

L

H

G

E

I

P

P

D

D

I

L

K

L

V

V

S

S

P

G

T

T

C

C

V

V

R
|
R

V

V

P

P

V

V

Y

F

V

T

G

G

H
|
H

S

S

E

L

A

S

V

I

T

N

I

A

E

E

T

F

Q

A

L

Q

P

P

I

L

T

S

A

P

E
|
E

E

R

A

A

R
|
R

E

E

I

L

L

L

M

D

K

G

A

A

P

T

G

G

V

V

I

Q

V

L

E

V

D

D

D

-

P

-

I

-

N

-

V

-

Y

V

P

P

V

T

P

P

I

L

E

A

V

A

A

A

G

G

K

V

D

D

D

E

V

S

F

L

V

V

G

G

R

R

I

I

R

R

K

R

D

D

A

P

G

G

F

V

E

P

N

D

-

G

-

R

G

G

L

L

S

A

M

L

W

F

I

V

V

S

G

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

L
|
L

L

L

active site: C129 (= C129), Q156 (= Q156), R248 (= R235), H255 (= H242)
binding cysteine: C129 (= C129), Q156 (= Q156), G160 (= G160), E223 (= E210), R248 (= R235), H255 (= H242)
binding glycerol: S108 (≠ P110), G187 (vs. gap), F192 (≠ Y181), P201 (≠ H190), Q225 (≠ M212), R228 (≠ I215), F229 (≠ N216), Q335 (= Q326), E338 (= E329), L339 (= L330)
binding sulfate ion: R98 (= R100), H117 (vs. gap), R119 (≠ W119), N128 (= N128), C129 (= C129), K226 (= K213), E270 (= E257), R273 (= R260)

Query Sequence

>WP_012674944.1 NCBI__GCF_000021545.1:WP_012674944.1
MKSYNVAILGATGAVGQTMIKVLEERNFPINEIRFLASERSAGKEVEYMGVKYKVEAVSE
DSFKGIDIALFSAGGERSKKWAPIAASKGAVVIDNSSAFRMDPDVPLVVPEVNPEDVKWH
KGIIANPNCSTIQMVVALYPIHKVKKIKRIIVATYQAVSGAGATAIADLENETKAVMEGR
YYYPQALPHHIAFNVIPRIDNFEPNGYTKEEMKMINETRKIMHEPDIKVSPTCVRVPVYV
GHSEAVTIETQLPITAEEAREILMKAPGVIVEDDPINNVYPVPIEVAGKDDVFVGRIRKD
AGFENGLSMWIVGDNLRKGAATNAVQIAELLIKYELI

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