PDB ligand accession: DFA
DrugBank: DB03588
PubChem:
ChEMBL:
InChI Key: PYHXGXCGESYPCW-UHFFFAOYSA-N
SMILES: OC(=O)C(C1=CC=CC=C1)C1=CC=CC=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
MET | 274 | Sulfoxidation | PyMOL_Chai1 | ||
MET | 275 | Sulfoxidation | PyMOL_Chai1 | ||
CYS | 319 | Glutathionylation | |||
CYS | 319 | S-nitrosylation | PyMOL_Chai1 |