Ligand name: berkeleyone A
PDB ligand accession: 8TC
DrugBank: n/a
PubChem: 57391090
ChEMBL: CHEMBL1911627
InChI Key: NNHHTFDBMMPBSL-JFPRQHOTSA-N
SMILES: CC1(C2CCC3(C(C2(CCC1O)C)CC4(C(=C)C3(C(=O)C(C4=O)(C)O)C(=O)OC)C)C)C
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein A0A1E1FFL0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5YBT	Download	Experimental	e5ybtA1 e5ybtB1	jelly-roll jelly-roll	LigPlot
5YBS	Download	Experimental	e5ybsA1 e5ybsB1	jelly-roll jelly-roll	LigPlot