Ligand name: N-OCTYL-2-HYDROXYETHYL SULFOXIDE
PDB ligand accession: OES
DrugBank: DB02415
PubChem: 9543425
ChEMBL: n/a
InChI Key: IRJUEMKMQDEOTQ-CYBMUJFWSA-N
SMILES: CCCCCCCCS(=O)CCO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organosulfur compounds
    • Class: Sulfoxides
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q9K597

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2XE5	Download	Experimental	e2xe5A1 e2xe5B1 e2xe5D1	Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels	LigPlot
2XE2	Download	Experimental	e2xe2A1 e2xe2B1 e2xe2C1	Outer membrane meander beta-barrels Outer membrane meander beta-barrels Outer membrane meander beta-barrels	LigPlot