Ligand name: 4-(4-propoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine
PDB ligand accession: MHR
DrugBank: DB08182
PubChem: 23727982
ChEMBL: CHEMBL270687
InChI Key: ZHMRPXZRUZLCNL-UHFFFAOYSA-N
SMILES: CCCOC1=C2C(NC=C2C2=NC(N)=NC=C2)=NC=C1
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 47 Phosphorylation PyMOL_RFAA
LYS 9 Ubiquitination
LYS 20 Ubiquitination
LYS 33 Ubiquitination
LYS 56 Ubiquitination
LYS 129 Ubiquitination
LYS 142 Ubiquitination