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Attributes

UniProt ID
Protein Name
Adenosine receptor A2a
Ligand Name
(2R,3R,4R)-2-[(8P)-6-amino-2-(hex-1-yn-1-yl)-8-(thiophen-2-yl)-9H-purin-9-yl]oxolane-3,4-diol
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MUHXGASCCALSAJ-PRIMNGNOSA-N
SMILES
CCCCC#Cc1nc(c2c(n1)n(c(n2)c3cccs3)C4C(C(CO4)O)O)N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 8CU6
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Color Legend
Unassigned regionsLigand / hetero atomse8cu6A1e8cu6A2
ECOD domains from experimental PDB structures interacting with ligand LJX
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P29274n/aLJX8cu6e8cu6A2A:0-1005,A:221-308
P29274n/aLJX8cu7e8cu7A2A:-3-1005,A:221-308