Ligand name: (1R,3R,4S,5R)-3-[3-[3,4-bis(oxidanyl)phenyl]propanoyloxy]-1,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid
PDB ligand accession: 7LH
DrugBank: n/a
PubChem: 129012043
ChEMBL: n/a
InChI Key: RLGFSACCIOSKQS-UNIGVISCSA-N
SMILES: c1cc(c(cc1CCC(=O)OC2CC(CC(C2O)O)(C(=O)O)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 X6Q997

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6LK2	Download	Experimental	e6lk2A1 e6lk2A2 e6lk2B1 e6lk2B2 e6lk2C1 e6lk2C2 e6lk2D1 e6lk2D2	alpha-helical domain in dehydroquinate synthase-like enzymes Flavodoxin-like alpha-helical domain in dehydroquinate synthase-like enzymes Flavodoxin-like alpha-helical domain in dehydroquinate synthase-like enzymes Flavodoxin-like Flavodoxin-like alpha-helical domain in dehydroquinate synthase-like enzymes	LigPlot