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Attributes

UniProt ID
Protein Name
ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1
Ligand Name
[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{S},4~{R},5~{R})-5-[5-[4-[[4-(2-methoxyethoxy)cyclohexyl]amino]-1-methyl-2-oxidanylidene-quinolin-6-yl]-1,3-thiazol-3-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VISHSDFFEFTKEI-QBEAZOKTSA-O
SMILES
CN1c2ccc(cc2C(=CC1=O)NC3CCC(CC3)OCCOC)c4c[n+](cs4)C5C(C(C(O5)COP(=O)(O)OP(=O)(O)OCC6C(C(C(O6)n7cnc8c7ncnc8N)O)O)O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 8D0M
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Color Legend
Unassigned regionsLigand / hetero atomse8d0mA1
ECOD domains from experimental PDB structures interacting with ligand Q2C
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P28907n/aQ2C8d0me8d0mA1A:45-283