Ligand name: (9beta,13alpha)-3-hydroxyestra-1,3,5(10)-trien-17-one
PDB ligand accession: J3Z
DrugBank: DB00655
PubChem: 5870
ChEMBL: CHEMBL1405
InChI Key: DNXHEGUUPJUMQT-CBZIJGRNSA-N
SMILES: CC12CCC3c4ccc(cc4CCC3C1CCC2=O)O
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q9BPX1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5HS6	Download	Experimental	e5hs6A1	Rossmann-like	LigPlot