Ligand name: 4-[(2~{S})-4-(3,4-dichlorophenyl)-2-(morpholin-4-ylmethyl)piperazin-1-yl]carbonyl-1~{H}-quinolin-2-one
PDB ligand accession: KAE
DrugBank: n/a
PubChem: 168477802
ChEMBL: n/a
InChI Key: LBLGMVCPRZTJIF-SFHVURJKSA-N
SMILES: c1ccc2c(c1)C(=CC(=O)N2)C(=O)N3CCN(CC3CN4CCOCC4)c5ccc(c(c5)Cl)Cl
Drug action: n/a

List of PDB structures and/or AlphaFold models with target protein P0DTC1

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
8GTV Download Experimental e8gtvA1
e8gtvA2
e8gtvB1
e8gtvB2
cradle loop barrel
Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain
Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain
cradle loop barrel
LigPlot