PDB ligand accession: GSH
DrugBank: DB00143
PubChem: 124886;25246407;171390563;
ChEMBL:
InChI Key: RWSXRVCMGQZWBV-WDSKDSINSA-N
SMILES: N[C@@H](CCC(=O)N[C@@H](CS)C(=O)NCC(O)=O)C(O)=O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
CYS | 77 | Glutathionylation | PyMOL_RFAA | ||
THR | 137 | Phosphorylation | PyMOL_RFAA | ||
SER | 73 | Phosphorylation | PyMOL_RFAA | ||
THR | 75 | Phosphorylation | PyMOL_RFAA |