Ligand name: 4-(4-METHYLPIPERAZIN-1-YL)-N-[5-(2-THIENYLACETYL)-1,5-DIHYDROPYRROLO[3,4-C]PYRAZOL-3-YL]BENZAMIDE
PDB ligand accession: 626
DrugBank: DB07186
PubChem: 11963557
ChEMBL: n/a
InChI Key: TYYNSDQVFIOSFH-UHFFFAOYSA-N
SMILES: CN1CCN(CC1)C1=CC=C(C=C1)C(=O)NC1=NNC2=CN(C=C12)C(=O)CC1=CC=CS1
Drug action: n/a

List of small molecule binding-associated PTMs for P53350

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 61 Acetylation PyMOL_RFAA
SER 137 Phosphorylation PyMOL_RFAA
LYS 61 Ubiquitination
LYS 66 Ubiquitination
LYS 82 Ubiquitination