Ligand name: 2-(6-CHLORO-3-{[2,2-DIFLUORO-2-(1-OXIDO-2-PYRIDINYL)ETHYL]AMINO}-2-OXO-1(2H)-PYRAZINYL)-N-[(2-FLUOROPHENYL)METHYL]ACETAMIDE
PDB ligand accession: CDD
DrugBank: DB07550
PubChem: 656913
ChEMBL: CHEMBL282837
InChI Key: ZIGSBBKEPNQXRG-UHFFFAOYSA-N
SMILES: [O-][N+]1=CC=CC=C1C(F)(F)CNC1=NC=C(Cl)N(CC(=O)NCC2=C(F)C=CC=C2)C1=O
Drug action: n/a

List of small molecule binding-associated PTMs for P00734

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	599	Acetylation			PyMOL_Chai1
SER	539	Phosphorylation			PyMOL_Chai1
THR	540	Phosphorylation			PyMOL_Chai1