Ligand name: 1-(8-{[(1S,2R,3S,4S,5R,6R)-2,3,4,5-tetrahydroxy-6-(hydroxymethyl)cyclohexyl]amino}octyl)triaza-1,2-dien-2-ium
PDB ligand accession: 66V
DrugBank: n/a
PubChem: 118988434
ChEMBL: n/a
InChI Key: KPTZFIOZQLVZBJ-SAAWNECCSA-N
SMILES: C(CCCCN=[N+]=N)CCCNC1C(C(C(C(C1O)O)O)O)CO
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Alcohols and polyols

List of PDB structures and/or AlphaFold models with target protein B3PEE6

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5I23	Download	Experimental	e5i23A2 e5i23A4	Glycosyl hydrolase domain-like TIM beta/alpha-barrel	LigPlot