Ligand name: (2S)-N-(isoquinolin-4-yl)-2-methyl-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
PDB ligand accession: U2I
DrugBank: n/a
PubChem: 168354935
ChEMBL: n/a
InChI Key: GDUZGWMNCDBRFJ-AWEZNQCLSA-N
SMILES: CC1CN(Cc2ccccc2O1)C(=O)Nc3cncc4c3cccc4
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
8DII Download Experimental e8diiA1
e8diiA2
Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain
cradle loop barrel
LigPlot