Ligand name: Alectinib
PDB ligand accession: EMH
DrugBank: DB11363
PubChem: 49806720
ChEMBL: CHEMBL1738797
InChI Key: KDGFLJKFZUIJMX-UHFFFAOYSA-N
SMILES: CCC1=CC2=C(C=C1N1CCC(CC1)N1CCOCC1)C(C)(C)C1=C(C3=CC=C(C=C3N1)C#N)C2=O
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