DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Plasmepsin III
Ligand Name
(4R)-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-3-[(2S,3S)-2-hydroxy-3-{[S-methyl-N-(phenylacetyl)-L-cysteinyl]ami no}-4-phenylbutanoyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
FCTXMHJXDHGIIN-ACUZRORGSA-N
SMILES
CC1(C(N(CS1)C(=O)C(C(Cc2ccccc2)NC(=O)C(CSC)NC(=O)Cc3ccccc3)O)C(=O)NC4c5ccccc5CC4O)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 3QVI
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Color Legend
Unassigned regionsLigand / hetero atomse3qviA2e3qviA3e3qviB2e3qviB3e3qviC2e3qviC3e3qviD2e3qviD3
ECOD domains from experimental PDB structures interacting with ligand K95
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q9Y006n/aK953qvie3qviA2A:0-174
Q9Y006n/aK953qvie3qviA3A:175-328
Q9Y006n/aK953qvie3qviB3B:175-328
Q9Y006n/aK953qvie3qviC3C:175-328
Q9Y006n/aK953qvie3qviD2D:0-174
Q9Y006n/aK953qvie3qviD3D:175-328