Ligand name: (1R,2S,3S,4R)-5-METHYLENECYCLOHEXANE-1,2,3,4-TETRAOL
PDB ligand accession: EXO
DrugBank: n/a
PubChem: 16122560
ChEMBL: n/a
InChI Key: DRZDCPGIBPDBFY-JWXFUTCRSA-N
SMILES: C=C1CC(C(C(C1O)O)O)O
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 Q9S5E2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2GRU	Download	Experimental	e2gruA1 e2gruA2	alpha-helical domain in dehydroquinate synthase-like enzymes Flavodoxin-like	LigPlot