Ligand name: (1R,3S,5Z)-5-[(2E)-2-{(1R,3aS,7aR)-1-[(1R,2S,4R)-2-butyl-4-hydroxy-1,5-dimethylhexyl]-7a-methyloctahydro-4H-inden-4-yli dene}ethylidene]-4-methylidenecyclohexane-1,3-diol
PDB ligand accession: ICJ
DrugBank: n/a
PubChem: 25233771
ChEMBL: CHEMBL454142
InChI Key: CJFXAKUNOBKWSJ-ZUNQKOJFSA-N
SMILES: CCCCC(CC(C(C)C)O)C(C)C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Steroids and steroid derivatives
      • Subclass: Vitamin D and derivatives

List of PDB structures and/or AlphaFold models with target protein P13053

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3AFR	Download	Experimental	e3afrA1	Nuclear receptor ligand-binding domain	LigPlot