PDB ligand accession: DEA
DrugBank: DB03769
PubChem:
ChEMBL:
InChI Key: LIEMBEWXEZJEEZ-INEUFUBQSA-N
SMILES: [H][C@@](O)(CN1C=NC2=C(N)N=CN=C12)[C@@]([H])(O)C(O)=O
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| LYS | 188 | Acetylation | PyMOL_RFAA | ||
| LYS | 186 | Acetylation | PyMOL_RFAA | ||
| SER | 154 | Phosphorylation | PyMOL_RFAA | ||
| SER | 183 | Phosphorylation | PyMOL_RFAA | ||
| TYR | 193 | Phosphorylation | PyMOL_Chai1 | ||
| SER | 198 | Phosphorylation | PyMOL_RFAA | ||
| THR | 185 | Phosphorylation | PyMOL_RFAA | ||
| SER | 187 | Phosphorylation | PyMOL_RFAA | ||
| THR | 158 | Phosphorylation | PyMOL_RFAA | ||
| THR | 157 | Phosphorylation | PyMOL_RFAA | ||
| THR | 159 | Phosphorylation | PyMOL_RFAA | ||
| CYS | 195 | S-nitrosylation | PyMOL_RFAA | ||
| MET | 29 | Sulfoxidation | PyMOL_RFAA | ||
| LYS | 186 | Ubiquitination | |||
| LYS | 188 | Ubiquitination |