PDB ligand accession: M7G
DrugBank: DB01960
PubChem: 444335;135460973;
ChEMBL: n/a
InChI Key: QQODJOAVWUWVHJ-KQYNXXCUSA-N
SMILES: CN1CN([C@@H]2O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)C2=C1C(=O)NC(N)=N2
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 108 | Acetylation | PyMOL_RFAA | ||
LYS | 159 | Acetylation | PyMOL_RFAA | ||
LYS | 162 | Acetylation | PyMOL_RFAA | ||
LYS | 206 | Malonylation | PyMOL_RFAA | ||
THR | 203 | Phosphorylation | PyMOL_RFAA | ||
SER | 207 | Phosphorylation | PyMOL_RFAA | ||
SER | 199 | Phosphorylation | PyMOL_RFAA | ||
THR | 205 | Phosphorylation | PyMOL_RFAA | ||
THR | 55 | Phosphorylation | PyMOL_RFAA | ||
SER | 92 | Phosphorylation | PyMOL_RFAA | ||
MET | 101 | Sulfoxidation | PyMOL_RFAA | ||
LYS | 159 | Ubiquitination |