DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Replicase polyprotein 1a
Ligand Name
N-{(2S,3R)-4-(benzylamino)-3-hydroxy-4-oxo-1-[(3S)-2-oxopyrrolidin-3-yl]butan-2-yl}-N~2~-[(benzyloxy)carbonyl]-L-leucinamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MPMTWRHFCLPCDF-OJJQZRKESA-N
SMILES
CC(C)CC(C(=O)NC(CC1CCNC1=O)C(C(=O)NCc2ccccc2)O)NC(=O)OCc3ccccc3
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 7K0H
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 atomse7k0hA1e7k0hA2e7k0hB1e7k0hB2
ECOD domains from experimental PDB structures interacting with ligand VR4
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P0C6U8n/aVR47k0he7k0hA1A:187-299
P0C6U8n/aVR47k0he7k0hA2A:2-186
P0C6U8n/aVR47k0he7k0hB1B:187-302
P0C6U8n/aVR47k0he7k0hB2B:2-186