Attributes
UniProt ID
Protein Name
Plasmepsin III
Ligand Name
(4R)-3-[(2S,3S)-3-{[(2,6-dimethylphenoxy)acetyl]amino}-2-hydroxy-4-phenylbutanoyl]-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide
DrugBank ID
n/a
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
KKTYZYHUPKXLPL-RIQJEONASA-N
SMILES
Cc1cccc(c1OCC(=O)NC(Cc2ccccc2)C(C(=O)N3CSC(C3C(=O)NC4c5ccccc5CC4O)(C)C)O)C
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3FNU
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Color Legend
Unassigned regionsLigand / hetero atomse3fnuA2e3fnuA3e3fnuB2e3fnuB3e3fnuC2e3fnuC3e3fnuD2e3fnuD3
ECOD domains from experimental PDB structures interacting with ligand 006
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| Q8IM15 | n/a | 006 | 3fnu | e3fnuA2 | A:0-174 |
| Q8IM15 | n/a | 006 | 3fnu | e3fnuA3 | A:175-327 |
| Q8IM15 | n/a | 006 | 3fnu | e3fnuB2 | B:0-174 |
| Q8IM15 | n/a | 006 | 3fnu | e3fnuB3 | B:175-327 |
| Q8IM15 | n/a | 006 | 3fnu | e3fnuC2 | C:0-174 |
| Q8IM15 | n/a | 006 | 3fnu | e3fnuC3 | C:175-327 |
| Q8IM15 | n/a | 006 | 3fnu | e3fnuD2 | D:0-174 |
| Q8IM15 | n/a | 006 | 3fnu | e3fnuD3 | D:175-327 |