DrugDomain

Attributes

UniProt ID

Protein Name

ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase nucleosidase

Ligand Name

[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3R,4R)-4-fluoro-3-hydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate

DrugBank ID

None

PDB Ligand Accession

AVU

ChEMBL ID

n/a

PubChem ID

n/a

InChIKey

GOCJJDZHXMDJEZ-WFCIOUKESA-N

SMILES

c1nc(c2c(n1)n(cn2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OCC4C(C(CO4)F)O)O)O)N

Drug Action

No data available

Affinity Metrics

No affinity data available

3D Structure

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Mol*

Structure: 3ZWP

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Color Legend

Unassigned regionsLigand / hetero atomse3zwpA1e3zwpB1e3zwpC1e3zwpD1e3zwpE1e3zwpF1e3zwpG1e3zwpH1

ECOD domains from experimental PDB structures interacting with ligand AVU

UniProt	DrugBank	PDB Ligand	PDB ID	ECOD Domain	Range Definition
P29241	n/a	AVU	3zwp	e3zwpA1	A:1-252
P29241	n/a	AVU	3zwp	e3zwpB1	B:-1-251
P29241	n/a	AVU	3zwp	e3zwpC1	C:1-251
P29241	n/a	AVU	3zwp	e3zwpD1	D:1-251
P29241	n/a	AVU	3zwp	e3zwpE1	E:1-251
P29241	n/a	AVU	3zwp	e3zwpF1	F:0-251
P29241	n/a	AVU	3zwp	e3zwpG1	G:1-251
P29241	n/a	AVU	3zwp	e3zwpH1	H:1-251
P29241	n/a	AVU	3zwv	e3zwvA1	A:1-253
P29241	n/a	AVU	3zwv	e3zwvB1	B:1-252
P29241	n/a	AVU	3zwv	e3zwvC1	C:1-252
P29241	n/a	AVU	3zwv	e3zwvD1	D:-1-250
P29241	n/a	AVU	3zwv	e3zwvE1	E:1-252
P29241	n/a	AVU	3zwv	e3zwvF1	F:1-252
P29241	n/a	AVU	3zwv	e3zwvG1	G:1-252
P29241	n/a	AVU	3zwv	e3zwvH1	H:1-252
P29241	n/a	AVU	3zww	e3zwwA1	A:1-252
P29241	n/a	AVU	3zww	e3zwwB1	B:-1-250
P29241	n/a	AVU	3zww	e3zwwC1	C:1-251
P29241	n/a	AVU	3zww	e3zwwD1	D:1-251
P29241	n/a	AVU	3zww	e3zwwE1	E:1-251
P29241	n/a	AVU	3zww	e3zwwF1	F:0-251
P29241	n/a	AVU	3zww	e3zwwG1	G:1-251
P29241	n/a	AVU	3zww	e3zwwH1	H:0-251