Ligand name: (3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL(1S,2R)-3-[[(4-AMINOPHENYL)SULFONYL](ISOBUTYL)AMINO]-1-BENZYL-2-HYDROXYPROPYLCARBAMATE
PDB ligand accession: 017
DrugBank: DB01264
PubChem: 213039
ChEMBL: CHEMBL1323
InChI Key: CJBJHOAVZSMMDJ-HEXNFIEUSA-N
SMILES: CC(C)CN(CC(C(Cc1ccccc1)NC(=O)OC2COC3C2CCO3)O)S(=O)(=O)c4ccc(cc4)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzenesulfonamides

List of PDB structures and/or AlphaFold models with target protein P04587

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3D1Z	Download	Experimental	e3d1zA1 e3d1zB1	cradle loop barrel cradle loop barrel	LigPlot
3D20	Download	Experimental	e3d20A1 e3d20B1	cradle loop barrel cradle loop barrel	LigPlot
2F81	Download	Experimental	e2f81A1 e2f81B1	cradle loop barrel cradle loop barrel	LigPlot
2F8G	Download	Experimental	e2f8gA1 e2f8gB1	cradle loop barrel cradle loop barrel	LigPlot
3CYW	Download	Experimental	e3cywA1 e3cywB1	cradle loop barrel cradle loop barrel	LigPlot
2F80	Download	Experimental	e2f80B1 e2f80A1	cradle loop barrel cradle loop barrel	LigPlot