SitesBLAST

SitesBLAST – Find functional sites

SitesBLAST

Comparing WP_012974960.1 NCBI__GCF_000010725.1:WP_012974960.1 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, 99% coverage: 3:337/339 of query aligns to 5:337/337 of P23247

query
sites
P23247

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C132 (= C131) active site, Acyl-thioester intermediate

2r00C Crystal structure of aspartate semialdehyde dehydrogenase ii complexed with asa from vibrio cholerae (see paper)
53% identity, 99% coverage: 3:337/339 of query aligns to 4:336/336 of 2r00C

query
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2r00C

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active site: C131 (= C131), Q158 (= Q158), R237 (= R236), H244 (= H243)
binding 2,2'-oxydiacetic acid: V15 (= V14), N95 (= N95), C131 (= C131), N315 (= N316)

Q04797 Aspartate-semialdehyde dehydrogenase; ASA dehydrogenase; ASADH; Aspartate-beta-semialdehyde dehydrogenase; EC 1.2.1.11 from Bacillus subtilis (strain 168) (see paper)
47% identity, 99% coverage: 2:338/339 of query aligns to 4:346/346 of Q04797

query
sites
Q04797

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S98 (= S97) modified: Phosphoserine
Y146 (≠ F147) modified: Phosphotyrosine

3q11A Crystals structure of aspartate beta-semialdehyde dehydrogenase from streptococcus pneumoniae with NADP and aspartyl beta- difluorophosphonate (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/358 of 3q11A

query
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3q11A

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S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G

G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A35 (= A36), S36 (= S37), R38 (≠ K39), S39 (= S40), T56 (≠ L58), A71 (≠ P73), T75 (≠ V77), G160 (= G164), M161 (≠ K165), G162 (≠ E166)
binding 5,5-difluoro-4-oxo-5-phosphono-D-norvaline: R98 (= R100), N126 (= N130), C127 (= C131), Q154 (= Q158), G158 (= G162), E219 (= E212), K222 (= K215), R244 (= R236)

4r5hA Crystal structure of sp-aspartate-semialdehyde-dehydrogenase with nicotinamide-adenine-dinucleotide-phosphate and 3-carboxy-propenyl- phthalic acid (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/359 of 4r5hA

query
sites
4r5hA

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N
x
A

V
|
V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K
x
R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S
|
S

P
x
A

G
|
G

A
x
S

K

S

V
x
T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

T
|
T

S
|
S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P
|
P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

S

S

G
|
G

A

A

G
|
G

K
x
M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E

E

W

M

K
|
K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R
|
R

V

I

P

P

T

V

F

L

I

S

G

A

H
|
H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G
|
G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

binding 3-[(1E)-3-carboxyprop-1-en-1-yl]benzene-1,2-dicarboxylic acid: S73 (≠ A75), T94 (= T96), S95 (= S97), R98 (= R100), N126 (= N130), C127 (= C131), Q154 (= Q158), G158 (= G162), K222 (= K215), R244 (= R236), H251 (= H243)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (≠ N13), V13 (= V14), A35 (= A36), S36 (= S37), R38 (≠ K39), S39 (= S40), T56 (≠ L58), S70 (= S72), A71 (≠ P73), G72 (= G74), T75 (≠ V77), N93 (= N95), T94 (= T96), P125 (= P129), N126 (= N130), C127 (= C131), G160 (= G164), M161 (≠ K165), G328 (= G320)

4r4jA Crystal structure of complex sp_asadh with 3-carboxypropyl-phthalic acid and nicotinamide adenine dinucleotide phosphate (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/359 of 4r4jA

query
sites
4r4jA

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N
x
A

V
|
V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K
x
R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S
|
S

P
x
A

G
|
G

A

S

K

S

V
x
T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

T
|
T

S
|
S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

S

S

G
|
G

A

A

G
|
G

K
x
M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E
|
E

E

E

W

M

K
|
K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R
|
R

V

I

P

P

T

V

F

L

I

S

G

A

H
|
H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G
|
G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

binding 3-(3-carboxypropyl)benzene-1,2-dicarboxylic acid: T94 (= T96), S95 (= S97), R98 (= R100), N126 (= N130), C127 (= C131), Q154 (= Q158), G158 (= G162), E219 (= E212), K222 (= K215), R244 (= R236), H251 (= H243)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (≠ N13), V13 (= V14), A35 (= A36), S36 (= S37), R38 (≠ K39), S39 (= S40), T56 (≠ L58), S70 (= S72), A71 (≠ P73), G72 (= G74), T75 (≠ V77), N93 (= N95), T94 (= T96), N126 (= N130), C127 (= C131), G160 (= G164), M161 (≠ K165), G328 (= G320)

3pyxB Crystals structure of aspartate beta-semialdehyde dehydrogenase complex with NADP and 2-aminoterephthalate (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/359 of 3pyxB

query
sites
3pyxB

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N
x
A

V
|
V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K
x
R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S
|
S

P
x
A

G
|
G

A

S

K

S

V
x
T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

T

T

S

S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N

N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

S
|
S

G
|
G

A

A

G
|
G

K
x
M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E
|
E

E

E

W

M

K
|
K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R
|
R

V

I

P

P

T

V

F

L

I

S

G

A

H

H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N
|
N

L
|
L

R

L

K

K

G

G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

binding 2-aminobenzene-1,4-dicarboxylic acid: R98 (= R100), G158 (= G162), E219 (= E212), K222 (= K215), R244 (= R236)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (≠ N13), V13 (= V14), A35 (= A36), S36 (= S37), R38 (≠ K39), S39 (= S40), T56 (≠ L58), S70 (= S72), A71 (≠ P73), G72 (= G74), T75 (≠ V77), C127 (= C131), S157 (= S161), G158 (= G162), G160 (= G164), M161 (≠ K165), N324 (= N316), L325 (= L317)

4r51A Crystal complex structure of sp-aspartate-semialdehyde-dehydrogenase with nicotinamide adenine dinucleotide phosphate and phthalic acid (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/360 of 4r51A

query
sites
4r51A

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N
x
A

V
|
V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K

R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S
|
S

P
x
A

G
|
G

A
x
S

K

S

V

T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

T
|
T

S
|
S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

S

S

G

G

A

A

G
|
G

K
x
M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E

E

W

M

K
|
K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R

R

V

I

P

P

T

V

F

L

I

S

G

A

H

H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G
|
G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (≠ N13), V13 (= V14), A35 (= A36), S36 (= S37), S39 (= S40), T56 (≠ L58), S70 (= S72), A71 (≠ P73), G72 (= G74), N93 (= N95), T94 (= T96), N126 (= N130), C127 (= C131), G160 (= G164), M161 (≠ K165), G328 (= G320)
binding phthalic acid: S73 (≠ A75), T94 (= T96), S95 (= S97), R98 (= R100), N126 (= N130), K222 (= K215)

4r54A Complex crystal structure of sp-aspartate-semialdehyde-dehydrogenase with 3-carboxy-ethyl-phthalic acid (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/357 of 4r54A

query
sites
4r54A

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N
x
A

V
|
V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K
x
R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S
|
S

P
x
A

G
|
G

A
x
S

K

S

V
x
T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

T
|
T

S
|
S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

S

S

G

G

A

A

G
|
G

K

M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E

E

W

M

K
|
K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R

R

V

I

P

P

T

V

F

L

I

S

G

A

H

H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G
|
G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

binding 3-(2-carboxyethyl)benzene-1,2-dicarboxylic acid: G72 (= G74), S73 (≠ A75), T94 (= T96), S95 (= S97), R98 (= R100), K222 (= K215)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (≠ N13), V13 (= V14), A35 (= A36), S36 (= S37), R38 (≠ K39), S39 (= S40), T56 (≠ L58), S70 (= S72), A71 (≠ P73), G72 (= G74), T75 (≠ V77), N93 (= N95), T94 (= T96), N126 (= N130), C127 (= C131), G160 (= G164), G328 (= G320)

4r41A Complex crystal structure of 4-nitro-2-phosphono-benzoic acid with sp- aspartate-semialdehyde dehydrogenase and nicotinamide-dinucleotide (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/357 of 4r41A

query
sites
4r41A

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N
x
A

V

V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K
x
R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S
|
S

P
x
A

G
|
G

A
x
S

K

S

V

T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

T
|
T

S
|
S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N

N

C

C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

S

S

G

G

A

A

G
|
G

K
x
M

E
x
G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E

E

W

M

K
|
K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R

R

V

I

P

P

T

V

F

L

I

S

G

A

H

H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G

G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

binding 4-nitro-2-phosphonobenzoic acid: S70 (= S72), G72 (= G74), S73 (≠ A75), N93 (= N95), T94 (= T96), S95 (= S97), R98 (= R100), K222 (= K215)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (≠ N13), A35 (= A36), S36 (= S37), R38 (≠ K39), S39 (= S40), T56 (≠ L58), A71 (≠ P73), G160 (= G164), M161 (≠ K165), G162 (≠ E166)

4r3nA Crystal structure of the ternary complex of sp-asadh with NADP and 1, 2,3-benzenetricarboxylic acid (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/357 of 4r3nA

query
sites
4r3nA

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N
x
A

V
|
V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K

R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S
|
S

P
x
A

G
|
G

A
x
S

K

S

V

T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

T
|
T

S
|
S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

S

S

G

G

A

A

G
|
G

K
x
M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E

E

W

M

K
|
K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R
|
R

V

I

P

P

T

V

F

L

I

S

G

A

H
|
H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G
|
G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

active site: C127 (= C131), Q154 (= Q158), R244 (= R236), H251 (= H243)
binding benzene-1,2,3-tricarboxylic acid: S73 (≠ A75), T94 (= T96), S95 (= S97), R98 (= R100), N126 (= N130), K222 (= K215)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (≠ N13), V13 (= V14), A35 (= A36), S36 (= S37), S39 (= S40), T56 (≠ L58), S70 (= S72), A71 (≠ P73), G72 (= G74), N93 (= N95), T94 (= T96), N126 (= N130), C127 (= C131), G160 (= G164), M161 (≠ K165), G328 (= G320)

3q1lA Crystals structure of aspartate beta-semialdehyde dehydrogenase from streptococcus pneumoniae with cysteamine bound covalently to cys 128 (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/357 of 3q1lA

query
sites
3q1lA

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G

G

A

A

T

T

G

G

N

A

V

V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A

A

S

S

E

A

K

R

S

S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L

T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S

S

P

A

G

G

A

S

K

S

V

T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

T

T

S

S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

S

S

G
|
G

A

A

G

G

K

M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E
|
E

E

E

W

M

K

K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R
|
R

V

I

P

P

T

V

F

L

I

S

G

A

H
|
H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G

G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

active site: C127 (= C131), Q154 (= Q158), R244 (= R236), H251 (= H243)
binding 2-amino-ethanethiol: N126 (= N130), C127 (= C131), G158 (= G162), E219 (= E212)

3pwsA Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with 2',5'-adenosine diphosphate and d-2- aminoadipate (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/357 of 3pwsA

query
sites
3pwsA

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N
x
A

V

V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K
x
R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S

S

P
x
A

G

G

A

S

K

S

V
x
T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

T

T

S

S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N
|
N

C

C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

S

S

G
|
G

A

A

G
|
G

K
x
M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I
|
I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E
|
E

E

E

W

M

K
|
K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R
|
R

V

I

P

P

T

V

F

L

I

S

G

A

H

H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G

G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

binding (2R)-2-aminohexanedioic acid: R98 (= R100), N126 (= N130), G158 (= G162), I208 (= I201), E219 (= E212), K222 (= K215), R244 (= R236)
binding adenosine-2'-5'-diphosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (≠ N13), A35 (= A36), S36 (= S37), R38 (≠ K39), S39 (= S40), T56 (≠ L58), A71 (≠ P73), T75 (≠ V77), G160 (= G164), M161 (≠ K165)

3pwkA Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with 2',5'-adenosine diphosphate and d-2- aminoadipate (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/357 of 3pwkA

query
sites
3pwkA

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N
x
A

V

V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K
x
R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S

S

P
x
A

G

G

A

S

K

S

V
x
T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

T

T

S

S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N
|
N

C

C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

S

S

G
|
G

A
|
A

G
|
G

K

M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E
|
E

E

E

W

M

K
|
K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R
|
R

V

I

P

P

T

V

F

L

I

S

G

A

H

H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G

G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

binding 5'-o-monophosphoryladenylyl(2'->5')adenylyl(2'->5')adenosine: G8 (= G9), T10 (= T11), G11 (= G12), A12 (≠ N13), A35 (= A36), S36 (= S37), R38 (≠ K39), S39 (= S40), T56 (≠ L58), A71 (≠ P73), T75 (≠ V77), G160 (= G164)
binding trans-cyclohexane-1,4-dicarboxylic acid: R98 (= R100), N126 (= N130), G158 (= G162), A159 (= A163), E219 (= E212), K222 (= K215), R244 (= R236)

2gz3A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with NADP and aspartate- semialdehyde (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/357 of 2gz3A

query
sites
2gz3A

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N
x
A

V
|
V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K
x
R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S
|
S

P
x
A

G
|
G

A

S

K

S

V
x
T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

T

T

S

S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N

N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

S

S

G
|
G

A

A

G
|
G

K
x
M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E
|
E

E

E

W

M

K

K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R
|
R

V

I

P

P

T

V

F

L

I

S

G

A

H
|
H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N
|
N

L

L

R

L

K

K

G

G

A
|
A

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

active site: C127 (= C131), Q154 (= Q158), R244 (= R236), H251 (= H243)
binding (2r)-2-amino-4-oxobutanoic acid: C127 (= C131), Q154 (= Q158), G158 (= G162), E219 (= E212), R244 (= R236), H251 (= H243)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (≠ N13), V13 (= V14), A35 (= A36), S36 (= S37), R38 (≠ K39), S39 (= S40), T56 (≠ L58), S70 (= S72), A71 (≠ P73), G72 (= G74), T75 (≠ V77), N93 (= N95), G158 (= G162), G160 (= G164), M161 (≠ K165), N324 (= N316), A329 (= A321)

2gz2A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with 2',5'-adp (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/357 of 2gz2A

query
sites
2gz2A

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N

A

V

V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K
x
R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S

S

P
x
A

G

G

A

S

K

S

V
x
T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

T

T

S

S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N

N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

S

S

G

G

A

A

G

G

K

M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E

E

W

M

K

K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R
|
R

V

I

P

P

T

V

F

L

I

S

G

A

H
|
H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G

G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

active site: C127 (= C131), Q154 (= Q158), R244 (= R236), H251 (= H243)
binding adenosine-2'-5'-diphosphate: G8 (= G9), T10 (= T11), G11 (= G12), A35 (= A36), S36 (= S37), R38 (≠ K39), S39 (= S40), T56 (≠ L58), A71 (≠ P73), T75 (≠ V77)

2gz1A Structure of aspartate semialdehyde dehydrogenase (asadh) from streptococcus pneumoniae complexed with NADP (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/357 of 2gz1A

query
sites
2gz1A

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G
|
G

A

A

T
|
T

G
|
G

N
x
A

V
|
V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A
|
A

S
|
S

E

A

K
x
R

S
|
S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L
x
T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S
|
S

P
x
A

G
|
G

A

S

K

S

V
x
T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N
|
N

T

T

S

S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N

N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q
|
Q

S

A

V

V

S
|
S

G
|
G

A

A

G
|
G

K
x
M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E

E

W

M

K

K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R
|
R

V

I

P

P

T

V

F

L

I

S

G

A

H
|
H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N
|
N

L
|
L

R

L

K

K

G

G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

active site: C127 (= C131), Q154 (= Q158), R244 (= R236), H251 (= H243)
binding nadp nicotinamide-adenine-dinucleotide phosphate: G8 (= G9), T10 (= T11), G11 (= G12), A12 (≠ N13), V13 (= V14), A35 (= A36), S36 (= S37), R38 (≠ K39), S39 (= S40), T56 (≠ L58), S70 (= S72), A71 (≠ P73), G72 (= G74), T75 (≠ V77), N93 (= N95), S157 (= S161), G158 (= G162), G160 (= G164), M161 (≠ K165), N324 (= N316), L325 (= L317)

3pylC Crystal structure of aspartate beta-semialdehide dehydrogenase from streptococcus pneumoniae with d-2,3-diaminopropionate (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/361 of 3pylC

query
sites
3pylC

G

G

Y

Y

T

T

V

V

A

A

V

V

I

V

G

G

A

A

T

T

G

G

N

A

V

V

G

G

R

A

E

Q

I

M

L

I

Q

K

T

M

L

L

A

E

E

E

R

S

K

T

F

L

P

P

A

I

D

D

T

K

V

I

I

R

A

Y

L

L

A

A

S

S

E

A

K

R

S

S

I

A

G

G

Q

K

E

S

V

L

S

K

Y

F

G

K

E

D

D

Q

D

D

I

I

L

-

K

T

V

I

Q

E

D

E

L

T

N

T

K

E

F

T

D

A

F

F

H

E

G

G

V

V

D

D

I

I

V

A

L

L

S

F

S

S

P

A

G

G

A

S

K

S

V

T

S

S

A

A

V

K

H

Y

V

A

P

P

R

Y

A

A

A

V

A

K

A

A

G

G

A

V

V

V

I

V

D

D

N

N

T

T

S

S

Q

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

L

L

A

D

G

A

Y

H

R

N

K

-

R

-

G

G

I

I

A

A

N

C

P

P

N
|
N

C
|
C

S

S

T

T

I

I

Q

Q

M

M

A

M

V

V

A

A

L

L

K

E

P

P

L

V

H

R

D

Q

R

K

F

W

K

G

I

L

H

D

R

R

V

I

V

V

S

S

T

T

Y

Y

Q

Q

S

A

V

V

S

S

G
|
G

A

A

G

G

K

M

E

G

A

A

M

I

D

L

E

E

L

T

F

Q

T

R

Q

E

T

L

R

R

A

E

I

V

F

L

V

-

N

N

D

D

P

G

V

V

A

K

-

P

-

C

-

D

-

L

-

H

-

A

-

E

-

I

-

L

-

P

-

S

-

G

-

D

K

K

S

K

V

H

F

Y

P

P

K

-

Q

-

I

I

A

A

F

F

N

N

V

A

I

L

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

Y

E
|
E

E

E

W

M

K

K

M

M

T

T

V

K

E

E

T

T

K

K

I

I

L

M

-

E

D

D

P

D

K

S

I

I

K

A

V

V

A

S

A

A

T

T

C

C

V

V

R
|
R

V

I

P

P

T

V

F

L

I

S

G

A

H

H

A

S

L

E

S

S

I

V

N

Y

I

I

E

E

T

T

E

K

E

E

P

V

I

A

S

P

A

I

E

E

A

V

R

K

V

A

L

I

R

A

A

A

A

F

P

P

G

G

L

A

S

V

V

L

V

E

D

D

Q

D

Q

V

T

A

G

H

E

Q

G

I

Y

Y

V

P

T

Q

P

A

V

I

E

N

V

A

A

V

G

G

D

S

N

R

P

D

V

T

F

F

V

V

S

G

R

R

I

I

R

R

D

K

D

D

I

L

T

D

V

A

E

E

N

K

G

G

L

I

S

H

F

M

W

W

C

V

V

V

A

S

D

D

N

N

L

L

R

L

K

K

G

G

A

A

L

W

N

N

A

S

V

V

Q

Q

I

I

A

A

E

E

L

T

L

L

binding 3-amino-D-alanine: N126 (= N130), C127 (= C131), G158 (= G162), E219 (= E212), R244 (= R236)

8jusA Crystal structure of aspartate semialdehyde dehydrogenase from porphyromonas gingivalis complexed with 2',5'adenosine diphosphate
45% identity, 97% coverage: 5:333/339 of query aligns to 3:330/335 of 8jusA

query
sites
8jusA

V

I

A

A

V

I

I

V

G
|
G

A

V

T
x
S

G
|
G

N

A

V

V

G

G

R

Q

E

E

I

F

L

L

Q

R

T

V

L

L

A

S

E

Q

R

R

K

D

F

F

P

P

A

I

D

D

T

G

V

L

I

Y

A

L

L

F

A
x
G

S
|
S

E

S

K
x
R

S
|
S

I

A

G

G

Q

S

E

V

V

Y

S

S

Y

F

G

K

E

G

D

K

D

E

I

Y

L

V

K

V

V

R

Q

E

D

L

L

K

N

D

K

N

F

D

D

D

F

F

H

K

G

G

V

I

D

D

I

I

V

A

L

F

S

C

S
|
S

P
x
A

G

G

A

G

K

D

V
x
T

S

S

A

I

V

A

H

F

V

A

P

D

R

T

A

I

A

T

A

R

A

H

G

G

A

T

V

L

V

M

I

I

D

D

N

N

T

S

S

S

Q

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

D

L

-

A

A

G

L

Y

V

R

H

K

P

R

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

A

V

V

V

A

A

L

L

K

K

P

P

L

I

H

E

D

D

R

L

F

S

K

H

I

I

H

R

R

R

V

V

V

H

V

V

S

A

T

T

Y

Y

Q

Q

S

A

V

A

S

S

G

G

A

A

G

G

K

A

E

L

A

G

M

M

D

A

E

E

L

L

F

V

T

Q

Q

Q

T

V

R

E

A

E

I

L

F

A

V

R

N

G

D

E

P

K

V

P

A

T

K

V

S

D

V

K

F

F

P

A

K

Y

Q

Q

I

L

A

M

F

Y

N

N

V

L

I

I

P

P

H

Q

I

I

D

D

V

V

F

F

M

T

E

D

D

N

G

D

S

Y

T

T

K

K

E

E

W

M

K

K

M

M

T

Y

V

R

E

E

T

T

K

K

K

R

I

I

L

M

D

H

P

S

K

D

I

V

K

M

V

V

A

S

A

A

T

T

C

C

V

V

R

R

V

V

P

P

T

V

F

M

I

R

G

A

H

H

A

S

L

E

S

A

I

I

N

W

I

V

E

E

T

T

E

E

E

R

P

P

I

I

S

A

A

P

E

E

A

A

R

R

V

A

L

F

R

A

A

K

A

A

P

P

G

G

L

V

S

L

V

L

V

C

D

D

Q

E

Q

P

T

S

G

E

E

K

G

Q

Y

Y

V

P

T

M

P

P

V

L

E

F

V

G

A

T

G

E

D

Q

N

D

P

P

V

V

F

I

V

V

S

G

R

R

I

I

R

R

D

Q

D

D

I

L

T

A

V

N

E

P

N

N

G

G

L

L

S

V

F

F

W

W

C

C

V

V

A

S

D

D

N

Q

L

I

R

R

K

K

G

G

A

A

L

L

N

N

A

A

V

V

Q

Q

I

I

A

A

E

E

L

Y

L

L

V

I

binding adenosine-2'-5'-diphosphate: G7 (= G9), S9 (≠ T11), G10 (= G12), G34 (≠ A36), S35 (= S37), R37 (≠ K39), S38 (= S40), S70 (= S72), A71 (≠ P73), T75 (≠ V77)

3tz6A Crystal structure of aspartate semialdehyde dehydrogenase complexed with inhibitor smcs (cys) and phosphate from mycobacterium tuberculosis h37rv (see paper)
46% identity, 98% coverage: 2:332/339 of query aligns to 1:340/342 of 3tz6A

query
sites
3tz6A

G

G

Y

L

T

S

V

I

A

G

V

I

I

V

G

G

A

A

T

T

G

G

N

Q

V

V

G

G

R

Q

E

V

I

M

L

R

Q

T

T

L

L

L

A

D

E

E

R

R

K

D

F

F

P

P

A

A

D

S

T

A

V

V

I

R

A

F

L

F

A

A

S

S

E

A

K

R

S

S

I

Q

G

G

Q

R

E

K

V

L

S

A

Y

F

G

R

E

G

D

Q

D

E

I

I

L

-

K

E

V

V

Q

E

D

D

L

A

N

E

K

T

F

A

D

D

F

P

H

S

G

G

V

L

D

D

I

I

V

A

L

L

S

F

S

S

P

A

G

G

A

S

K

A

V

M

S

S

A

K

V

V

H

Q

V

A

P

P

R

R

A

F

A

A

G

G

A

V

V

T

V

V

I

I

D

D

N

N

T

S

S

S

Q

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

L

D

A

A

G
x
H

Y

R

R
|
R

K

P

R

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

A

M

V

P

A

V

L

L

K

K

P

V

L

L

H

H

D

D

R

E

F

A

K

R

I

L

H

V

R

R

V

L

V

V

S

S

T

S

Y

Y

Q
|
Q

S

A

V

V

S

S

G
|
G

A

S

G

G

K

L

E

A

A

G

M

V

D

A

E

E

L

L

F

A

T

E

Q

Q

T

A

R

R

A

A

I

V

-

I

-

G

-

A

-

E

-

Q

F

L

V

V

N

Y

D

D

P
x
G

V

G

A

A

K

L

S

E

V
x
F

F

P

P

P

K

P

Q

N

-

T

-

Y

-

V

-

A

-
x
P

I

I

A

A

F

F

N

N

V

V

I

V

P

P

H

L

I

A

D

G

V

S

F

L

M

V

E

D

D

D

G

G

S

S

-

G

-

E

T

T

K

D

E
|
E

E

D

W
x
Q

K
|
K

M

L

T
x
R

V
x
F

E

E

T

S

K

R

K

K

I

I

L

L

D

G

-

I

P

P

K

D

I

L

K

L

V

V

A

S

A

G

T

T

C

C

V

V

R
|
R

V

V

P

P

T

V

F

F

I

T

G

G

H
|
H

A

S

L

L

S

S

I

I

N

N

I

A

E

E

T

F

E

A

E

Q

P

P

I

L

S

S

A

P

E
|
E

E

R

A

A

R
|
R

V

E

V

L

L

L

R

D

A

G

A

A

P

T

G

G

L

V

S

Q

V

L

V

V

D

D

Q

-

T

-

G

-

E

-

G

-

Y

V

V

P

T

T

P

P

V

L

E

A

V

A

A

A

G

G

D

V

N

D

P

E

V

S

F

L

V

V

S

G

R

R

I

I

R

R

D

R

D

D

I

P

T

G

V

V

E

P

N

D

-

G

-

R

G

G

L

L

S

A

F

L

W

F

C

V

V

S

A

G

D

D

N

N

L

L

R

R

K

K

G

G

A

A

L

L

N

N

A

T

V

I

Q
|
Q

I

I

A

A

E
|
E

L
|
L

L

L

active site: C129 (= C131), Q156 (= Q158), R248 (= R236), H255 (= H243)
binding cysteine: C129 (= C131), Q156 (= Q158), G160 (= G162), E223 (= E212), R248 (= R236), H255 (= H243)
binding glycerol: S108 (≠ P110), G187 (≠ P183), F192 (≠ V188), P201 (vs. gap), Q225 (≠ W214), R228 (≠ T217), F229 (≠ V218), Q335 (= Q327), E338 (= E330), L339 (= L331)
binding sulfate ion: R98 (= R100), H117 (≠ G119), R119 (= R121), N128 (= N130), C129 (= C131), K226 (= K215), E270 (= E258), R273 (= R261)

Query Sequence

>WP_012974960.1 NCBI__GCF_000010725.1:WP_012974960.1
MGYTVAVIGATGNVGREILQTLAERKFPADTVIALASEKSIGQEVSYGEDDILKVQDLNK
FDFHGVDIVLSSPGAKVSAVHVPRAAAAGAVVIDNTSQFRMDPDVPLVVPEVNPEALAGY
RKRGIIANPNCSTIQMAVALKPLHDRFKIHRVVVSTYQSVSGAGKEAMDELFTQTRAIFV
NDPVAKSVFPKQIAFNVIPHIDVFMEDGSTKEEWKMTVETKKILDPKIKVAATCVRVPTF
IGHALSINIETEEPISAEEARVVLRAAPGLSVVDQQTGEGYVTPVEVAGDNPVFVSRIRD
DITVENGLSFWCVADNLRKGAALNAVQIAELLVRDYMVE

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