Ligand name: [4-({5-(AMINOCARBONYL)-4-[(3-METHYLPHENYL)AMINO]PYRIMIDIN-2-YL}AMINO)PHENYL]ACETIC ACID
PDB ligand accession: S91
DrugBank: DB08513
PubChem: 24871491
ChEMBL: n/a
InChI Key: PAIQRYUOBBCBSE-UHFFFAOYSA-N
SMILES: CC1=CC(NC2=NC(NC3=CC=C(CC(O)=O)C=C3)=NC=C2C(N)=O)=CC=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P06213

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	1112	Acetylation		PyMOL_RFAA
SER	1033	Phosphorylation		PyMOL_RFAA
TYR	1038	Phosphorylation		PyMOL_RFAA	PyMOL_Chai1
CYS	1165	S-nitrosylation		PyMOL_RFAA
LYS	1057	Ubiquitination
LYS	1174	Ubiquitination