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 P12499

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4DQC	Download	Experimental	e4dqcB1 e4dqcA1	cradle loop barrel cradle loop barrel	LigPlot
4DQH	Download	Experimental	e4dqhA1 e4dqhB1	cradle loop barrel cradle loop barrel	LigPlot
4DQF	Download	Experimental	e4dqfB1 e4dqfA1	cradle loop barrel cradle loop barrel	LigPlot
4DQB	Download	Experimental	e4dqbA1 e4dqbB1	cradle loop barrel cradle loop barrel	LigPlot
4DQE	Download	Experimental	e4dqeA1 e4dqeB1	cradle loop barrel cradle loop barrel	LigPlot