Ligand name: Gilteritinib
PDB ligand accession: C6F
DrugBank: DB12141
PubChem: 49803313
ChEMBL: CHEMBL3301622
InChI Key: GYQYAJJFPNQOOW-UHFFFAOYSA-N
SMILES: CCC1=C(NC2CCOCC2)N=C(NC2=CC=C(N3CCC(CC3)N3CCN(C)CC3)C(OC)=C2)C(=N1)C(N)=O
Drug action: n/a

List of small molecule binding-associated PTMs for P36888

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
TYR 842 Phosphorylation PyMOL_RFAA PyMOL_Chai1
THR 820 Phosphorylation PyMOL_RFAA