Ligand name: Bosutinib
PDB ligand accession: DB8
DrugBank: DB06616
PubChem: 5328940
ChEMBL: CHEMBL288441
InChI Key: UBPYILGKFZZVDX-UHFFFAOYSA-N
SMILES: COC1=CC(NC2=C(C=NC3=CC(OCCCN4CCN(C)CC4)=C(OC)C=C23)C#N)=C(Cl)C=C1Cl
Drug action: n/a

List of small molecule binding-associated PTMs for Q13555

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
SER 26 Phosphorylation PyMOL_RFAA
THR 306 Phosphorylation PyMOL_RFAA
SER 146 Phosphorylation PyMOL_RFAA