Ligand name: (3S)-5-chloro-N-(isoquinolin-4-yl)-N-propanoyl-2,3-dihydro-1-benzofuran-3-carboxamide
PDB ligand accession: QML
DrugBank: n/a
PubChem: 169452774
ChEMBL: n/a
InChI Key: PKWRGHQHQAGUOY-QGZVFWFLSA-N
SMILES: CCC(=O)N(c1cncc2c1cccc2)C(=O)C3COc4c3cc(cc4)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
7GJE	Download	Experimental	e7gjeA1 e7gjeA2 e7gjeB1 e7gjeA1 e7gjeB1 e7gjeB2	cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot