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Attributes

UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
N-{1-BENZYL-2,2-DIFLUORO-3,3-DIHYDROXY-4-[3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRYLAMINO]-5-PHENYL-PENTYL}-3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRAMIDE
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
CGJKKYBHEOTRNM-ZQWQDMLBSA-N
SMILES
CC(C)C(C(=O)NC(Cc1ccccc1)C(C(C(Cc2ccccc2)NC(=O)C(C(C)C)NC(=O)N(C)Cc3ccccn3)(F)F)(O)O)NC(=O)N(C)Cc4ccccn4
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 1DIF
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Color Legend
Unassigned regionsLigand / hetero atomse1difA1e1difB1
ECOD domains from experimental PDB structures interacting with ligand A85
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P03367n/aA851dife1difA1A:1-99
P03367n/aA851dife1difB1B:1-99