Ligand name: 3-Fluoro-4-{[(2R)-2-hydroxy-2-(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthalenyl)acetyl]amino}benzoic acid
PDB ligand accession: 394
DrugBank: DB07031
PubChem: 445455
ChEMBL: n/a
InChI Key: AANFHDFOMFRLLR-LJQANCHMSA-N
SMILES: CC1(C)CCC(C)(C)C2=C1C=CC(=C2)[C@@H](O)C(=O)NC1=C(F)C=C(C=C1)C(O)=O
Drug action: n/a

List of small molecule binding-associated PTMs for P13631

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 401 Sumoylation