PDB ligand accession: T1X
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: UCQMGGDLMJSQEJ-LHXIGDLBSA-N
SMILES: CC(C)CC(C(=O)NC(CC1CCNC1=O)C(c2nc3c(cccc3s2)F)O)NC(=O)c4cc5c(ccc(c5[nH]4)F)OC
Drug action: n/a
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
8DOY | Download | Experimental | e8doyA1 e8doyA2 e8doyB1 e8doyB2 | 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 |