Ligand name: Paratoulene phosphate
PDB ligand accession: 843
DrugBank: DB04495
PubChem: 447518
ChEMBL: CHEMBL25826
InChI Key: GGPXNASQNUOIPB-NSOVKSMOSA-N
SMILES: CC(=O)N[C@@H](CC1=CC=C(OP(O)(O)=O)C=C1)C(=O)N[C@H]1CCCCN(CC2=CC=C(C=C2)C2=CC=CC=C2)C1=O
Drug action: n/a

List of small molecule binding-associated PTMs for P12931

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 203 Acetylation PyMOL_RFAA
THR 182 Phosphorylation PyMOL_RFAA
THR 183 Phosphorylation PyMOL_RFAA
TYR 187 Phosphorylation PyMOL_Chai1
TYR 216 Phosphorylation PyMOL_Chai1
SER 180 Phosphorylation PyMOL_RFAA
SER 190 Phosphorylation PyMOL_RFAA
THR 218 Phosphorylation PyMOL_RFAA
SER 219 Phosphorylation PyMOL_RFAA
LYS 184 Ubiquitination