Ligand name: (1R,4S,5R)-1,4,5-trihydroxy-3-[(5-methyl-1-benzothiophen-2-yl)methoxy]cyclohex-2-ene-1-carboxylic acid
PDB ligand accession: CB6
DrugBank: n/a
PubChem: 44468170
ChEMBL: CHEMBL1208355
InChI Key: BNUWPGVZRDEWEX-ISTRZQFTSA-N
SMILES: Cc1ccc2c(c1)cc(s2)COC3=CC(CC(C3O)O)(C(=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 Q48255

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2WKS	Download	Experimental	e2wksA1 e2wksB1 e2wksB1 e2wksE1 e2wksC1 e2wksF1 e2wksC1 e2wksD1 e2wksA1 e2wksE1 e2wksD1 e2wksF1	Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like Flavodoxin-like	LigPlot