DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Replicase polyprotein 1ab
Ligand Name
(3R)-3-(3,4-dichlorophenyl)-1-(isoquinolin-4-yl)piperidin-2-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
CJNMPNBDTPWBLB-MRXNPFEDSA-N
SMILES
c1ccc2c(c1)cncc2N3CCCC(C3=O)c4ccc(c(c4)Cl)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 7GJL
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 atomse7gjlA1e7gjlA2e7gjlB1e7gjlB2
ECOD domains from experimental PDB structures interacting with ligand QOC
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P0DTD1n/aQOC7gjle7gjlA1A:187-301
P0DTD1n/aQOC7gjle7gjlA2A:1-186
P0DTD1n/aQOC7gjle7gjlB1B:1-186