Ligand name: Irosustat
PDB ligand accession: 667
DrugBank: DB02292
PubChem: 5287541
ChEMBL: CHEMBL286738
InChI Key: DSLPMJSGSBLWRE-UHFFFAOYSA-N
SMILES: NS(=O)(=O)OC1=CC=C2C3=C(CCCCC3)C(=O)OC2=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P00918

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
SER 29 Phosphorylation PyMOL_RFAA