DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Endothiapepsin
Ligand Name
4-(2-{[methyl(prop-2-yn-1-yl)amino]methyl}-1,3-thiazol-4-yl)piperidin-4-ol
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NZKQXJFLCYAWDP-UHFFFAOYSA-N
SMILES
CN(CC#C)Cc1nc(cs1)C2(CCNCC2)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 5QBJ
Hover over the Mol* viewer to rotate or zoom with the mouse. Move the cursor out of the viewer to go back to normal page scrolling and one-click navigation.
Hover inside the viewer to rotate or zoom. Move out to scroll the page or click links normally.
Color Legend
Unassigned regionsLigand / hetero atomse5qbjA1e5qbjA2
ECOD domains from experimental PDB structures interacting with ligand D8V
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P11838n/aD8V5qbje5qbjA1A:1-178
P11838n/aD8V5qbje5qbjA2A:179-330