Ligand name: 2-{2-[(3,5-dimethylphenyl)amino]pyrimidin-4-yl}-N-[(1S)-2-hydroxy-1-methylethyl]-4-methyl-1,3-thiazole-5-carboxamide
PDB ligand accession: 685
DrugBank: DB07194
PubChem: 25113172
ChEMBL: CHEMBL512172
InChI Key: PEGXADGTBNRSGV-ZDUSSCGKSA-N
SMILES: [H][C@](C)(CO)NC(=O)C1=C(C)N=C(S1)C1=NC(NC2=CC(C)=CC(C)=C2)=NC=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P43405

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 402 Acetylation PyMOL_RFAA PyMOL_Chai1
SER 379 Phosphorylation PyMOL_RFAA PyMOL_Chai1
THR 384 Phosphorylation PyMOL_RFAA PyMOL_Chai1