Ligand name: Brigatinib
PDB ligand accession: 6GY
DrugBank: DB12267
PubChem: 68165256
ChEMBL: CHEMBL3545311
InChI Key: AILRADAXUVEEIR-UHFFFAOYSA-N
SMILES: COC1=CC(=CC=C1NC1=NC=C(Cl)C(NC2=CC=CC=C2P(C)(C)=O)=N1)N1CCC(CC1)N1CCN(C)CC1
Drug action: n/a

List of small molecule binding-associated PTMs for Q9UM73

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
TYR 1131 Phosphorylation PyMOL_RFAA PyMOL_Chai1
SER 1206 Phosphorylation PyMOL_RFAA