Ligand name: (3R,3aS,3bR,6aS,7aS)-octahydrodifuro[2,3-b:3',2'-d]furan-3-yl [(1S,2R)-1-benzyl-2-hydroxy-3-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}propyl]carbamate
PDB ligand accession: G52
DrugBank: n/a
PubChem: 46891890
ChEMBL: CHEMBL1232930
InChI Key: QWMNYFXRFHGYGS-DDGGWZRMSA-N
SMILES: CC(C)CN(CC(C(Cc1ccccc1)NC(=O)OC2COC3C2C4CCOC4O3)O)S(=O)(=O)c5ccc(cc5)OC
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P03367

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4HEG	Download	Experimental	e4hegB1 e4hegA1	cradle loop barrel cradle loop barrel	LigPlot
4J54	Download	Experimental	e4j54A1 e4j54B1 e4j54B1	cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot
8DCH	Download	Experimental	e8dchA1 e8dchB1	cradle loop barrel cradle loop barrel	LigPlot
4HE9	Download	Experimental	e4he9A1 e4he9B1	cradle loop barrel cradle loop barrel	LigPlot
4HDP	Download	Experimental	e4hdpB1 e4hdpA1	cradle loop barrel cradle loop barrel	LigPlot
4HDF	Download	Experimental	e4hdfB1 e4hdfA1	cradle loop barrel cradle loop barrel	LigPlot
4HDB	Download	Experimental	e4hdbA1 e4hdbB1	cradle loop barrel cradle loop barrel	LigPlot