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Attributes

UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
4-{[4-(2,6-difluoro-4-methoxybenzene-1-carbonyl)pyrimidin-2-yl]amino}benzonitrile
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
FZZMKUKEMAVUGK-UHFFFAOYSA-N
SMILES
COc1cc(c(c(c1)F)C(=O)c2ccnc(n2)Nc3ccc(cc3)C#N)F
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 5K14
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Color Legend
Unassigned regionsLigand / hetero atomse5k14A1e5k14A2e5k14A3e5k14A4e5k14B1e5k14B2e5k14B3
ECOD domains from experimental PDB structures interacting with ligand IB1
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P04585n/aIB15k14e5k14A3A:317-428
P04585n/aIB15k14e5k14A4A:1-242