SitesBLAST

1suwA Crystal structure of a NAD kinase from archaeoglobus fulgidus in complex with its substrate and product: insights into the catalysis of NAD kinase (see paper)
34% identity, 64% coverage: 19:182/255 of query aligns to 19:183/249 of 1suwA

query
sites
1suwA

A

A

L

L

A

K

R

R

L

L

E

E

Q

V

-

E

-

V

-

E

-

L

-

F

R

N

Y

Q

P

P

H

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E

D

E

P

L

G

E

E

N

A

F

D

D

V

F

I

I

I

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G

G
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G

D
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D

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G

F

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I

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L

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F

-

V

L

D

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C

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Y

F

G

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M

I

N

N

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V

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G

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L

L

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T

N

H

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Y

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E

E

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N

G

F

L

E

I

V

E

E

R

-

L

L

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K

K

A

A

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E

E

V

-

I

-

L

K

H

F

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E

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A

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C

G

S

E

A

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E

D

A

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L

L

A

A

I

L

N
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N

E
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E

V

I

S

A

L

V

L

L

R

-

E

-

T

S

R

R

Q

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A

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A
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A

K

K

L
x
M

-

I

-

D

-

V

R

A

I

L

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I

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D

D

G

G

K

-

I

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D

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x
R

C

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D

G

G

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A

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G

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S

T
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T

A

G

Y
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Y

N

A

L

F

S
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S

A

A

H

G

G

G

P

P

I

V

P

E

L

P

G

Y

A

L

G

E

I

C

A

F

A

I

L

L

T

I

P

P

I

I

S

A

A

P

F
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F

R

R

binding nadp nicotinamide-adenine-dinucleotide phosphate: G48 (= G43), D49 (= D44), G50 (= G45), N115 (= N114), E116 (= E115), A125 (= A126), M127 (≠ L128), R143 (≠ I142), D145 (= D144), T156 (= T155), Y158 (= Y157), S161 (= S160), F182 (= F181)

Sites not aligning to the query:

binding nadp nicotinamide-adenine-dinucleotide phosphate: 209, 210

O30297 NAD kinase; ATP-dependent NAD kinase; EC 2.7.1.23 from Archaeoglobus fulgidus (strain ATCC 49558 / DSM 4304 / JCM 9628 / NBRC 100126 / VC-16) (see paper)
34% identity, 64% coverage: 19:182/255 of query aligns to 19:183/249 of O30297

query
sites
O30297

A

A

L

L

A

K

R

R

L

L

E

E

Q

V

-

E

-

V

-

E

-

L

-

F

R

N

Y

Q

P

P

H

S

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E

D

E

P

L

G

E

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N

A

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D

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F

I

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D

G
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G

F

T

M

I

L

L

E
x
R

T

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Q

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F

-

V

L

D

K

R

R

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C

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P

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G

M

I

N

N

R

T

G

G

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V

G

G

F

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L

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N

H

V

A

Y

S

R

P

E

E

H

N

G

F

L

E

I

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E

E

R

-

L

L

S

K

K

K

A

A

E

V

E

E

V

-

I

-

L

K

H

F

P

E

L

V

R

E

M

R

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A

S

S

C

G

S

E

A

E

M

V

P

E

D

A

V

L

L

A

A

I

L

N
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N

E
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E

V

I

S

A

L

V

L

L

R

-

E

-

T

S

R

R

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K

A

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A

A

K
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K

L

M

-

I

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D

-

V

R

A

I

L

R

R

I

V

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D

G

G

K

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D

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x
R

C

C

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D

G

G

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S

A

T

T

P

Q

A
x
I

G

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T
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T

A
x
G

Y
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Y

N
x
A

L
x
F

S
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S

A

A

H

G

G

G

P

P

I

V

P

E

L

P

G

Y

A

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G

E

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A

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A

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L

T

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P

I

I

S

A

A

P

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F

R

R

DG 49:50 (= DG 44:45) binding
R54 (≠ E49) binding
NE 115:116 (= NE 114:115) binding
K126 (= K127) binding
R143 (≠ I142) binding
I153 (≠ A152) binding
TGYAFS 156:161 (≠ TAYNLS 155:160) binding

Sites not aligning to the query:

211 binding

3afoA Crystal structure of yeast nadh kinase complexed with nadh
32% identity, 70% coverage: 35:212/255 of query aligns to 111:294/360 of 3afoA

query
sites
3afoA

A

T

D

D

V

L

I

L

I

V

A

T

L

L

G

G

D
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D

G
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G

F

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M

I

L
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L

E

H

T

G

L

V

H

S

R

M

F

F

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D

N

R

T

R

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V

P

P

-

P

I

V

Y

L

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A

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N

A

R

L

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G

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L

G

G

F
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F

L

L

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S

N

P

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Y

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E

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N

E

S

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A

A

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M

N
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N

E
x
D

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E

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N

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D

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C

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P

A

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G

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T

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Y

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L

L

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S

A

A

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S

P

P

L

L

G

V

A

P

G

A

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A

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L

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P

P

V

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S

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A

S

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V

binding 1,4-dihydronicotinamide adenine dinucleotide: D120 (= D44), G121 (= G45), L124 (= L48), F148 (= F71), N196 (= N114), D197 (≠ E115), T237 (= T155), A238 (= A156), Y239 (= Y157), S242 (= S160)

Sites not aligning to the query:

binding 1,4-dihydronicotinamide adenine dinucleotide: 300, 301

6rg8A Crystal structure of NAD kinase 1 from listeria monocytogenes in complexe with an inhibitor (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/260 of 6rg8A

query
sites
6rg8A

A

A

A

G

L

F

A

G

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E

L

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V

D

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P

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G

-

E

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A

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D

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I

A

S

L

I

G

G

D
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D

G
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G

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L

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F

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x
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R

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P

-

A

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M

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Y

G

G

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K

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L

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I

L

N
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N

E
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E

V

-

S

S

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K

E

S

T

S

R

G

Q

G

A

P

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G

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G

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D

G

G

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P

A

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G

G

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T

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A

Y
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Y

N

N

L

K

S
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S

A

L

H

G

G

G

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A

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L

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H

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P

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A

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G

E

I

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A

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M

S

A

A

S

F

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N

P

N

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R

binding (2~{R},3~{R},4~{S},5~{R})-2-(6-aminopurin-9-yl)-5-[[4-(6-azanyl-9~{H}-purin-8-yl)but-3-ynylamino]methyl]oxolane-3,4-diol: D45 (= D44), G46 (= G45), F74 (= F71), Y75 (≠ L72), N119 (= N114), E120 (= E115), T158 (= T155), A159 (= A156), Y160 (= Y157), S163 (= S160)

Sites not aligning to the query:

binding (2~{R},3~{R},4~{S},5~{R})-2-(6-aminopurin-9-yl)-5-[[4-(6-azanyl-9~{H}-purin-8-yl)but-3-ynylamino]methyl]oxolane-3,4-diol: 219

6rbyA Crystal structure of NAD kinase 1 from listeria monocytogenes in complexe with an adenine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/260 of 6rbyA

query
sites
6rbyA

A

A

A

G

L

F

A

G

R

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L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

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G

G

D
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D

G

G

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M

F

L

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-

L

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I

N

H

R

T

G

G

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V

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F

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x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

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E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

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K

A

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E

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Y

E

Q

V

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V

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P

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R

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M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E

E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

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L

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D

I

V

R

V

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I

D

N

G

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K

D

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M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
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T

A
|
A

Y

Y

N

N

L

K

S

S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

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A

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M

A

Q

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L

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T

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E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding 4-(6-azanyl-8-bromanyl-purin-9-yl)butan-1-ol: D45 (= D44), F74 (= F71), Y75 (≠ L72), N119 (= N114), T158 (= T155), A159 (= A156)

8a9vA Crystal structure of NAD kinase 1 from listeria monocytogenes in complex with a linear di-adenosine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 8a9vA

query
sites
8a9vA

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

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Y

Y

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V

D

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P

P

G

-

E

-

A

-

D

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L

I

G

G

D
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D

G

G

F

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M

F

L
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L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

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R

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L

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A

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F

Y

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G

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x
L

G

G

F
|
F

L
x
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M

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-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

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L

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K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

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K

I

V

L

S

H

Y

P

P

L

L

R

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M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E
|
E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

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I

V

R

V

I

I

D

N

G

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K

D

I

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M

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D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

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M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y
|
Y

N

N

L

K

S
|
S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding ~{N}-[[(2~{R},3~{S},4~{R},5~{R})-5-[8-[3-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]prop-1-ynyl]-6-azanyl-purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-2-azanyl-ethanesulfonamide: D45 (= D44), L49 (= L48), L72 (≠ V69), F74 (= F71), Y75 (≠ L72), N119 (= N114), E120 (= E115), T158 (= T155), A159 (= A156), Y160 (= Y157), S163 (= S160)

Sites not aligning to the query:

binding ~{N}-[[(2~{R},3~{S},4~{R},5~{R})-5-[8-[3-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]prop-1-ynyl]-6-azanyl-purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-2-azanyl-ethanesulfonamide: 220

7zzjA Crystal structure of NAD kinase 1 from listeria monocytogenes in complex with a linear di-adenosine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 7zzjA

query
sites
7zzjA

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D
|
D

G
|
G

F

T

M

F

L

L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S

H

V
x
L

G

G

F
|
F

L
x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E
|
E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y
|
Y

N

N

L

K

S
|
S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding (1~{R},23~{R},24~{S},25~{R})-14-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-7-azanyl-24,25-bis(oxidanyl)-26-oxa-2,4,6,9,14,17,21-heptazatetracyclo[21.2.1.0^{2,10}.0^{3,8}]hexacosa-3(8),4,6,9-tetraen-11-yne-16,20-dione: D45 (= D44), G46 (= G45), L72 (≠ V69), F74 (= F71), Y75 (≠ L72), N119 (= N114), E120 (= E115), T158 (= T155), A159 (= A156), Y160 (= Y157), S163 (= S160)

Sites not aligning to the query:

binding (1~{R},23~{R},24~{S},25~{R})-14-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-7-azanyl-24,25-bis(oxidanyl)-26-oxa-2,4,6,9,14,17,21-heptazatetracyclo[21.2.1.0^{2,10}.0^{3,8}]hexacosa-3(8),4,6,9-tetraen-11-yne-16,20-dione: 220

7zzgA Crystal structure of NAD kinase 1 from listeria monocytogenes in complex with a linear di-adenosine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 7zzgA

query
sites
7zzgA

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D
|
D

G
|
G

F

T

M

F

L

L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S

H

V

L

G

G

F
|
F

L
x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E
|
E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y
|
Y

N

N

L

K

S
|
S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding (1~{R},24~{R},25~{S},26~{R})-14-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-7-azanyl-25,26-bis(oxidanyl)-27-oxa-2,4,6,9,14,17,20,22-octazatetracyclo[22.2.1.0^{2,10}.0^{3,8}]heptacosa-3(8),4,6,9-tetraen-11-yne-16,21-dione: D45 (= D44), G46 (= G45), F74 (= F71), Y75 (≠ L72), N119 (= N114), E120 (= E115), T158 (= T155), A159 (= A156), Y160 (= Y157), S163 (= S160)

Sites not aligning to the query:

binding (1~{R},24~{R},25~{S},26~{R})-14-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-7-azanyl-25,26-bis(oxidanyl)-27-oxa-2,4,6,9,14,17,20,22-octazatetracyclo[22.2.1.0^{2,10}.0^{3,8}]heptacosa-3(8),4,6,9-tetraen-11-yne-16,21-dione: 220

7zzeA Crystal structure of NAD kinase 1 from listeria monocytogenes in complex with a linear di-adenosine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 7zzeA

query
sites
7zzeA

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D
|
D

G
|
G

F

T

M

F

L

L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S

H

V

L

G

G

F
|
F

L
x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E
|
E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A
x
S

G

G

S

T

T
|
T

A
|
A

Y
|
Y

N

N

L

K

S
|
S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding (1~{R},25~{R},26~{S},27~{R})-14-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-7-azanyl-26,27-bis(oxidanyl)-28-oxa-2,4,6,9,14,17,21,23-octazatetracyclo[23.2.1.0^{2,10}.0^{3,8}]octacosa-3(8),4,6,9-tetraen-11-yne-16,22-dione: D45 (= D44), G46 (= G45), F74 (= F71), Y75 (≠ L72), N119 (= N114), E120 (= E115), S155 (≠ A152), T158 (= T155), A159 (= A156), Y160 (= Y157), S163 (= S160)

Sites not aligning to the query:

binding (1~{R},25~{R},26~{S},27~{R})-14-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl]-7-azanyl-26,27-bis(oxidanyl)-28-oxa-2,4,6,9,14,17,21,23-octazatetracyclo[23.2.1.0^{2,10}.0^{3,8}]octacosa-3(8),4,6,9-tetraen-11-yne-16,22-dione: 220

7zzcA Crystal structure of NAD kinase 1 from listeria monocytogenes in complex with a linear di-adenosine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 7zzcA

query
sites
7zzcA

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D
|
D

G
|
G

F

T

M

F

L
|
L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S

H

V

L

G

G

F
|
F

L
x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E
|
E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y
|
Y

N

N

L

K

S
|
S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding 2-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-[3-[6-azanyl-9-[(2~{R},3~{R},4~{S},5~{R})-5-[(2-azanylethylsulfonylamino)methyl]-3,4-bis(oxidanyl)oxolan-2-yl]purin-8-yl]prop-2-ynyl]amino]ethanoic acid: D45 (= D44), G46 (= G45), L49 (= L48), F74 (= F71), Y75 (≠ L72), N119 (= N114), E120 (= E115), T158 (= T155), A159 (= A156), Y160 (= Y157), S163 (= S160)

7zzaA Crystal structure of NAD kinase 1 from listeria monocytogenes in complex with a linear di-adenosine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 7zzaA

query
sites
7zzaA

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D
|
D

G
|
G

F

T

M

F

L
|
L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S

H

V

L

G

G

F
|
F

L
x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E
|
E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y
|
Y

N

N

L

K

S
|
S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding 2-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-[3-[6-azanyl-9-[(2~{R},3~{R},4~{S},5~{R})-5-[(3-azanylpropylcarbamoylamino)methyl]-3,4-bis(oxidanyl)oxolan-2-yl]purin-8-yl]prop-2-ynyl]amino]ethanoic acid: D45 (= D44), G46 (= G45), L49 (= L48), F74 (= F71), Y75 (≠ L72), N119 (= N114), E120 (= E115), T158 (= T155), A159 (= A156), Y160 (= Y157), S163 (= S160)

6z61A Crystal structure of NAD kinase 1 from listeria monocytogenes in complex with a di-adenosine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 6z61A

query
sites
6z61A

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D
|
D

G

G

F

T

M

F

L
|
L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S

H

V

L

G

G

F
|
F

L
x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E
|
E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y
|
Y

N

N

L

K

S

S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding (2~{R},3~{R},4~{S},5~{R})-2-[6-azanyl-8-[3-[[(2~{R},3~{S},4~{R},5~{R})-5-[6-(2-azanylethylamino)purin-9-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]prop-1-ynyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol: D45 (= D44), L49 (= L48), F74 (= F71), Y75 (≠ L72), N119 (= N114), E120 (= E115), T158 (= T155), A159 (= A156), Y160 (= Y157)

6rr2A Crystal structure of NAD kinase 1 from listeria monocytogenes in complexe with an adenine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 6rr2A

query
sites
6rr2A

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D

D

G

G

F

T

M

F

L

L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S

H

V

L

G

G

F
|
F

L
x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E
|
E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y
|
Y

N

N

L

K

S
|
S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding 9-[(2~{S})-oxan-2-yl]purin-6-amine: F74 (= F71), Y75 (≠ L72), N119 (= N114), T158 (= T155), A159 (= A156)
binding 5'-deoxy-5'-methylthioadenosine: N119 (= N114), E120 (= E115), Y160 (= Y157), S163 (= S160)

6rgfA Crystal structure of NAD kinase 1 from listeria monocytogenes in complex with an inhibitor
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 6rgfA

query
sites
6rgfA

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D
|
D

G
|
G

F

T

M

F

L
|
L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S
x
H

V

L

G

G

F
|
F

L
x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E
|
E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y
|
Y

N

N

L

K

S
|
S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding [(2~{R},3~{R},4~{R},5~{R})-2-[8-[3-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-methyl-amino]prop-1-ynyl]-6-azanyl-purin-9-yl]-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl] dihydrogen phosphate: D45 (= D44), G46 (= G45), L49 (= L48), H71 (≠ S68), F74 (= F71), Y75 (≠ L72), N119 (= N114), E120 (= E115), T158 (= T155), A159 (= A156), Y160 (= Y157), S163 (= S160)

6rgbA Crystal structure of NAD kinase 1 from listeria monocytogenes in complexe with an inhibitor (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 6rgbA

query
sites
6rgbA

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D
|
D

G
|
G

F

T

M

F

L
|
L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S

H

V

L

G

G

F
|
F

L
x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E
|
E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y
|
Y

N

N

L

K

S
|
S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding (2~{R},3~{R},4~{S},5~{R})-2-(6-aminopurin-9-yl)-5-[[3-[6-azanyl-9-[(2~{R},3~{R},4~{S},5~{R})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-8-yl]prop-2-ynylamino]methyl]oxolane-3,4-diol: D45 (= D44), G46 (= G45), L49 (= L48), F74 (= F71), Y75 (≠ L72), N119 (= N114), E120 (= E115), T158 (= T155), A159 (= A156), Y160 (= Y157), S163 (= S160)

6rc5A Crystal structure of NAD kinase 1 from listeria monocytogenes in complexe with an adenine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 6rc5A

query
sites
6rc5A

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D
|
D

G
|
G

F

T

M

F

L
|
L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S

H

V

L

G

G

F
|
F

L

Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E

E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y

Y

N

N

L

K

S

S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding 9-ethyl-8-ethynyl-purin-6-amine: D45 (= D44), G46 (= G45), L49 (= L48), F74 (= F71), N119 (= N114), T158 (= T155), A159 (= A156)

6rc4A Crystal structure of NAD kinase 1 from listeria monocytogenes in complexe with an adenine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 6rc4A

query
sites
6rc4A

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D
|
D

G

G

F

T

M

F

L

L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S

H

V

L

G

G

F
|
F

L
x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E

E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y

Y

N

N

L

K

S

S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding 2-(6-azanyl-8-methyl-purin-9-yl)ethanol: D45 (= D44), F74 (= F71), Y75 (≠ L72), N119 (= N114), T158 (= T155), A159 (= A156)

6rc2A Crystal structure of NAD kinase 1 from listeria monocytogenes in complexe with an adenine derivative (see paper)
28% identity, 67% coverage: 18:187/255 of query aligns to 22:190/261 of 6rc2A

query
sites
6rc2A

A

A

A

G

L

F

A

G

R

E

L

Y

E

D

Q

M

R

E

Y

Y

P

D

H

D

V

V

D

E

P

P

G

-

E

-

A

-

D

E

V

I

I

V

I

I

A

S

L

I

G

G

D
|
D

G

G

F

T

M

F

L

L

E

S

T

A

L

F

H

H

R

Q

F

Y

V

E

D

E

R

R

-

L

-

D

R

E

V

I

P

A

I

F

Y

I

G

G

M

I

N

H

R

T

G

G

S

H

V

L

G

G

F
|
F

L
x
Y

M

A

N

D

V

-

Y

W

R

R

-

P

-

A

-

E

E

A

H

D

G

K

L

L

I

V

E

K

R

L

L

L

S

A

K

K

A

G

E

E

-

Y

E

Q

V

K

I

V

L

S

H

Y

P

P

L

L

R

-

M

L

K

K

A

T

R

T

T

V

A

K

S

Y

G

G

E

K

E

E

V

A

E

T

A

Y

L

L

A

A

I

L

N
|
N

E

E

V

-

S

S

L

T

L

V

R

K

E

S

T

S

R

G

Q

G

A

P

A

F

K

V

L

V

R

D

I

V

R

V

I

I

D

N

G

-

K

D

I

I

R

H

M

F

D

E

E

R

L

F

I

R

C

G

D

D

G

G

I

L

L

C

L

M

S

S

T

T

P

P

A

S

G

G

S

T

T
|
T

A
|
A

Y

Y

N

N

L

K

S

S

A

L

H

G

G

G

P

A

I

L

I

M

P

H

L

P

G

S

A

I

G

E

I

A

A

M

A

Q

L

L

T

T

P

E

I

M

S

A

A

S

F

I

R

N

P

N

R

R

R

V

W

Y

R

R

binding 8-methyl-9-pent-4-ynyl-purin-6-amine: D45 (= D44), F74 (= F71), Y75 (≠ L72), N119 (= N114), T158 (= T155), A159 (= A156)

Query Sequence

>WP_011382609.1 NCBI__GCF_000009985.1:WP_011382609.1
MIFSSIAFVAAETEAAKAALARLEQRYPHVDPGEADVIIALGGDGFMLETLHRFVDRRVP
IYGMNRGSVGFLMNVYREHGLIERLSKAEEVILHPLRMKARTASGEEVEALAINEVSLLR
ETRQAAKLRIRIDGKIRMDELICDGILLSTPAGSTAYNLSAHGPIIPLGAGIAALTPISA
FRPRRWRGALLPHTAKVVFEILEAGKRPVSAVADYTEARDVVEVEVREDRTCDLVMLFDP
EHNLEERIITEQFLP

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