Ligand name: 1-(5-Tert-Butyl-2-Methyl-2h-Pyrazol-3-Yl)-3-(4-Chloro-Phenyl)-Urea
PDB ligand accession: BMU
DrugBank: DB02277
PubChem: 446816
ChEMBL: CHEMBL87277
InChI Key: FWIJKWMXNHRSRO-UHFFFAOYSA-N
SMILES: CN1N=C(C=C1NC(=O)NC1=CC=C(Cl)C=C1)C(C)(C)C
Drug action: n/a

List of small molecule binding-associated PTMs for Q16539

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 53 Acetylation PyMOL_RFAA
SER 32 Phosphorylation PyMOL_RFAA
TYR 323 Phosphorylation PyMOL_Chai1
TYR 140 Phosphorylation PyMOL_Chai1
TYR 35 Phosphorylation PyMOL_Chai1
SER 37 Phosphorylation PyMOL_RFAA
LYS 152 Acetylation PyMOL_RFAA
LYS 152 Ubiquitination