PDB ligand accession: I54
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: VHSJYWSZMIFGBF-GSVKDTAISA-N
SMILES: CC(C)CC(C(=O)NC(CC1CCNC1=O)C(O)S(=O)(=O)O)NC(=O)OCc2ccccc2Cl
Drug action: n/a
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7TIW | Download | Experimental | e7tiwA1 e7tiwA2 | Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel | LigPlot |