Ligand name: tert-butyl [(2R,6S,12Z,13aS,14aR,16aS)-2-[(7-methoxy-3-methylquinoxalin-2-yl)oxy]-14a-{[(1-methylcyclopropyl)sulfonyl]carbamoyl}-5,16-dioxo-1,2,3,5,6,7,8,9,10,11,13a,14,14a,15,16,16a-hexadecahydrocyclopropa[e]pyrrolo[1,2-a][1,4]diazacyclopentadecin-6-yl]carbamate
PDB ligand accession: 9H4
DrugBank: n/a
PubChem: 129009721
ChEMBL: CHEMBL4092714
InChI Key: OCYIAXNHVLIDIT-IIVIQOIMSA-N
SMILES: Cc1c(nc2cc(ccc2n1)OC)OC3CC4C(=O)NC5(CC5C=CCCCCCC(C(=O)N4C3)NC(=O)OC(C)(C)C)C(=O)NS(=O)(=O)C6(CC6)C
Drug action: n/a

List of PDB structures and/or AlphaFold models with target protein A8DG50

PDB/AF Accession PyMOL script Experimental / Predicted Interacting ECOD domains ECOD X-group name LigPlot
5VOJ Download Experimental e5vojA1
cradle loop barrel
LigPlot
7MME Download Experimental e7mmeA1
cradle loop barrel
LigPlot