DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Gag-Pol polyprotein
Ligand Name
methyl {(2S)-1-[2-(biphenyl-4-ylmethyl)-2-{(4R)-4-hydroxy-5-{[(2S)-3-methyl-1-oxo-1-(prop-2-en-1-ylamino)butan-2-yl]amino}-5-oxo-4-[4-(prop-2-en-1-yl)benzyl]pentyl}hydrazinyl]-3,3-dimethyl-1-oxobutan-2-yl}carbamate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VXCLCFNUDTXLDD-NAAHQDJQSA-N
SMILES
CC(C)C(C(=O)NCC=C)NC(=O)C(CCCN(Cc1ccc(cc1)c2ccccc2)NC(=O)C(C(C)(C)C)NC(=O)OC)(Cc3ccc(cc3)CC=C)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4COE
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Color Legend
Unassigned regionsLigand / hetero atomse4coeA1e4coeB1
ECOD domains from experimental PDB structures interacting with ligand M17
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P03366n/aM174coee4coeA1A:1-99
P03366n/aM174coee4coeB1B:101-199