Attributes
UniProt ID
Protein Name
Insulin-degrading enzyme
Ligand Name
2-[[2-[[(2S)-3-(3H-IMIDAZOL-4-YL)-1-METHOXY-1-OXO-PROPAN-2-YL]AMINO]-2-OXO-ETHYL]-(PHENYLMETHYL)AMINO]ETHANOIC ACID
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VJXRDRMNYWCCEG-HNNXBMFYSA-N
SMILES
COC(=O)C(Cc1cnc[nH]1)NC(=O)CN(Cc2ccccc2)CC(=O)O
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 2YPU
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Color Legend
Unassigned regionsLigand / hetero atomse2ypuA1e2ypuA11e2ypuA12e2ypuA13e2ypuB5e2ypuB6e2ypuB7e2ypuB8
ECOD domains from experimental PDB structures interacting with ligand I41
| UniProt | DrugBank | PDB Ligand | PDB ID | ECOD Domain | Range Definition |
|---|---|---|---|---|---|
| P14735 | n/a | I41 | 2ypu | e2ypuA11 | A:528-766 |
| P14735 | n/a | I41 | 2ypu | e2ypuA12 | A:287-527 |
| P14735 | n/a | I41 | 2ypu | e2ypuB6 | B:528-763 |
| P14735 | n/a | I41 | 2ypu | e2ypuB7 | B:287-527 |
| P14735 | n/a | I41 | 4dtt | e4dttA11 | A:528-763 |
| P14735 | n/a | I41 | 4dtt | e4dttA12 | A:287-527 |
| P14735 | n/a | I41 | 4dtt | e4dttB18 | B:528-763 |
| P14735 | n/a | I41 | 4dtt | e4dttB19 | B:287-527 |