DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Replicase polyprotein 1a
Ligand Name
5-[(azetidin-3-yl)amino]-2-methyl-N-[(1R)-1-(3-{5-[(pyrrolidin-1-yl)methyl]thiophen-2-yl}phenyl)ethyl]benzamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ZTKSBNLNPMUGBL-HXUWFJFHSA-N
SMILES
Cc1ccc(cc1C(=O)NC(C)c2cccc(c2)c3ccc(s3)CN4CCCC4)NC5CNC5
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 7LBS
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 atomse7lbsA1e7lbsA2e7lbsB1e7lbsB2
ECOD domains from experimental PDB structures interacting with ligand XR8
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P0DTC1n/aXR87lbse7lbsA1A:61-315
P0DTC1n/aXR87lbse7lbsB1B:61-315