PDB ligand accession: QR5
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: CDPYVHPXDFRJSH-AREMUKBSSA-N
SMILES: CC(c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)NC(=O)CN4CCN(C4=O)C5CC5
Drug action: n/a
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7GJU | Download | Experimental | e7gjuA1 e7gjuA2 e7gjuB2 | cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel | LigPlot |