Ligand name: PH-797804
PDB ligand accession: I45
DrugBank: DB07941
PubChem: 22049997
ChEMBL: CHEMBL1088751
InChI Key: KCAJXIDMCNPGHZ-UHFFFAOYSA-N
SMILES: CNC(=O)C1=CC=C(C)C(=C1)N1C(C)=CC(OCC2=C(F)C=C(F)C=C2)=C(Br)C1=O
Drug action: n/a

List of small molecule binding-associated PTMs for Q16539

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	53	Acetylation		PyMOL_RFAA
LYS	152	Acetylation		PyMOL_RFAA
SER	28	Phosphorylation		PyMOL_RFAA
SER	32	Phosphorylation		PyMOL_RFAA
TYR	24	Phosphorylation			PyMOL_Chai1
SER	37	Phosphorylation		PyMOL_RFAA
LYS	152	Ubiquitination