Ligand name: Valdecoxib
PDB ligand accession: COX
DrugBank: DB00580
PubChem: 119607
ChEMBL: CHEMBL865
InChI Key: LNPDTQAFDNKSHK-UHFFFAOYSA-N
SMILES: CC1=C(C(=NO1)C1=CC=CC=C1)C1=CC=C(C=C1)S(N)(=O)=O
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