PDB ligand accession: 5UD
DrugBank: DB01629
PubChem:
ChEMBL:
InChI Key: FHIDNBAQOFJWCA-UAKXSSHOSA-N
SMILES: OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=C(F)C(=O)NC1=O
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| ALA | 2 | Acetylation | PyMOL_RFAA | ||
| LYS | 24 | Acetylation | PyMOL_RFAA | ||
| LYS | 4 | Acetylation | PyMOL_RFAA | ||
| SER | 35 | Phosphorylation | PyMOL_RFAA | ||
| SER | 99 | Phosphorylation | PyMOL_RFAA | ||
| LYS | 31 | Ubiquitination | |||
| THR | 3 | Phosphorylation | PyMOL_RFAA |