Ligand name: (4S)-6-chloro-N-(isoquinolin-4-yl)-2-(2-methoxyethyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
PDB ligand accession: R1I
DrugBank: n/a
PubChem: 169408311
ChEMBL: n/a
InChI Key: BDYIWAGQQMTVBW-HXUWFJFHSA-N
SMILES: COCCN1Cc2ccc(cc2C(C1)C(=O)Nc3cncc4c3cccc4)Cl
Drug action: n/a

List of PDB structures and/or AlphaFold models with target protein P0DTD1

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
7GKX Download Experimental e7gkxA1
e7gkxA2
e7gkxB1
cradle loop barrel
Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain
cradle loop barrel
LigPlot