Ligand name: 2-{[(3alpha,5beta,7alpha,8alpha,14beta,17alpha)-3,7-dihydroxy-24-oxocholan-24-yl]amino}ethanesulfonic acid
PDB ligand accession: 5D5
DrugBank: DB08834
PubChem: 9848818
ChEMBL: CHEMBL272427
InChI Key: BHTRKEVKTKCXOH-LBSADWJPSA-N
SMILES: CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Lipids and lipid-like molecules
    • Class: Steroids and steroid derivatives
      • Subclass: Bile acids, alcohols and derivatives

List of PDB structures and/or AlphaFold models with target protein Q64610

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5DLV	Download	Experimental	e5dlvA4 e5dlvA6 e5dlvB4 e5dlvA6 e5dlvB6	Somatomedin B domain Alkaline phosphatase-like Somatomedin B domain Alkaline phosphatase-like Alkaline phosphatase-like	LigPlot
5DLW	Download	Experimental	e5dlwA1 e5dlwA5	Alkaline phosphatase-like Somatomedin B domain	LigPlot