Ligand name: (2R)-1-(DIMETHYLAMINO)-3-{4-[(6-{[2-FLUORO-5-(TRIFLUOROMETHYL)PHENYL]AMINO}PYRIMIDIN-4-YL)AMINO]PHENOXY}PROPAN-2-OL
PDB ligand accession: 3FP
DrugBank: DB07054
PubChem: 448994
ChEMBL: n/a
InChI Key: OSCWQKTUILTARV-MRXNPFEDSA-N
SMILES: [H][C@](O)(COC1=CC=C(NC2=NC=NC(NC3=C(F)C=CC(=C3)C(F)(F)F)=C2)C=C1)CN(C)C
Drug action: n/a

List of small molecule binding-associated PTMs for P24941

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 33 Acetylation PyMOL_RFAA
LYS 9 Acetylation PyMOL_RFAA
LYS 20 Acetylation PyMOL_RFAA
THR 14 Phosphorylation PyMOL_RFAA
TYR 15 Phosphorylation PyMOL_Chai1
TYR 19 Phosphorylation PyMOL_Chai1
THR 165 Phosphorylation PyMOL_RFAA
LYS 9 Ubiquitination
LYS 20 Ubiquitination
LYS 33 Ubiquitination
LYS 129 Ubiquitination
LYS 142 Ubiquitination