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Attributes

UniProt ID
Protein Name
Replicase polyprotein 1ab
Ligand Name
(4S)-6-chloro-N-(isoquinolin-4-yl)-2-(2-methoxyethyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
BDYIWAGQQMTVBW-HXUWFJFHSA-N
SMILES
COCCN1Cc2ccc(cc2C(C1)C(=O)Nc3cncc4c3cccc4)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 7GKX
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Color Legend
Unassigned regionsLigand / hetero atomse7gkxA1e7gkxA2e7gkxB1e7gkxB2
ECOD domains from experimental PDB structures interacting with ligand R1I
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P0DTD1n/aR1I7gkxe7gkxA1A:1-186
P0DTD1n/aR1I7gkxe7gkxA2A:187-302
P0DTD1n/aR1I7gkxe7gkxB1B:1-186