Ligand name: {3-[(5-CHLORO-1,3-BENZOTHIAZOL-2-YL)METHYL]-2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-1(2H)-YL}ACETIC ACID
PDB ligand accession: 47D
DrugBank: DB07093
PubChem: 10450624
ChEMBL: CHEMBL159820
InChI Key: RQWICELTTDJODO-UHFFFAOYSA-N
SMILES: OC(=O)CN1C=CC(=O)N(CC2=NC3=CC(Cl)=CC=C3S2)C1=O
Drug action: n/a

List of small molecule binding-associated PTMs for P15121

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 308 Acetylation PyMOL_RFAA
LYS 22 Acetylation PyMOL_RFAA
CYS 299 Glutathionylation PyMOL_RFAA
THR 20 Phosphorylation PyMOL_RFAA
TYR 49 Phosphorylation PyMOL_Chai1
SER 77 Phosphorylation PyMOL_RFAA
SER 211 Phosphorylation PyMOL_RFAA
SER 215 Phosphorylation PyMOL_RFAA
TYR 210 Phosphorylation PyMOL_Chai1
SER 303 Phosphorylation PyMOL_RFAA
THR 305 Phosphorylation PyMOL_RFAA
SER 306 Phosphorylation PyMOL_RFAA
CYS 299 S-nitrosylation PyMOL_RFAA
CYS 304 S-nitrosylation PyMOL_RFAA
SER 23 Phosphorylation PyMOL_RFAA