PDB ligand accession: FIS
DrugBank: DB02101
PubChem:
ChEMBL:
InChI Key: WAAPEIZFCHNLKK-QPUJVOFHSA-N
SMILES: [H]N([H])C(=O)[C@@H]1C[C@@]2(N([H])C(=O)N([H])C2=O)C2=C(O1)C=CC(F)=C2
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| LYS | 263 | Acetylation | PyMOL_RFAA | ||
| LYS | 22 | Acetylation | PyMOL_RFAA | ||
| CYS | 299 | Glutathionylation | PyMOL_RFAA | ||
| LYS | 263 | Malonylation | PyMOL_RFAA | ||
| THR | 20 | Phosphorylation | PyMOL_RFAA | ||
| SER | 23 | Phosphorylation | PyMOL_RFAA | ||
| TYR | 49 | Phosphorylation | PyMOL_Chai1 | ||
| SER | 215 | Phosphorylation | PyMOL_RFAA | ||
| SER | 303 | Phosphorylation | PyMOL_RFAA | ||
| CYS | 299 | S-nitrosylation | PyMOL_RFAA | ||
| LYS | 263 | Ubiquitination |