DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Replicase polyprotein 1ab
Ligand Name
2-(3-chlorophenyl)-N-{6-[(methanesulfonyl)(methyl)amino]isoquinolin-4-yl}acetamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
NWQAGGFPSKOROJ-UHFFFAOYSA-N
SMILES
CN(c1ccc2cncc(c2c1)NC(=O)Cc3cccc(c3)Cl)S(=O)(=O)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 7GML
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 atomse7gmlA1e7gmlA2e7gmlB1e7gmlB2
ECOD domains from experimental PDB structures interacting with ligand RL0
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P0DTD1n/aRL07gmle7gmlA1A:187-305
P0DTD1n/aRL07gmle7gmlA2A:1-186
P0DTD1n/aRL07gmle7gmlB1B:187-305
P0DTD1n/aRL07gmle7gmlB2B:1-186