Ligand name: (8alpha,10alpha,13alpha,17beta)-17-[(4-hydroxyphenyl)carbonyl]androsta-3,5-diene-3-carboxylic acid
PDB ligand accession: MUF
DrugBank: DB08220
PubChem: 9845059
ChEMBL: n/a
InChI Key: RPNNXCYIESWDSC-JRZBRKEGSA-N
SMILES: [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C=C(CC[C@]4(C)[C@@]3([H])CC[C@]12C)C(O)=O)C(=O)C1=CC=C(O)C=C1
Drug action: n/a

List of small molecule binding-associated PTMs for Q96RI1

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
SER 359 Phosphorylation PyMOL_RFAA