PDB ligand accession: PMS
DrugBank: DB03297
PubChem:
ChEMBL:
InChI Key: NIXKBAZVOQAHGC-UHFFFAOYSA-N
SMILES: OS(=O)(=O)CC1=CC=CC=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 53 | Acetylation | PyMOL_RFAA | ||
TYR | 58 | Nitration | PyMOL_Chai1 | ||
TYR | 58 | Phosphorylation | PyMOL_Chai1 |