PDB ligand accession: GUN
DrugBank: DB02377
PubChem: 764;5274253;135398634;
ChEMBL:
InChI Key: UYTPUPDQBNUYGX-UHFFFAOYSA-N
SMILES: NC1=NC(=O)C2=C(N1)N=CN2
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 254 | Acetylation | PyMOL_RFAA | ||
CYS | 206 | Glutathionylation | PyMOL_RFAA | ||
SER | 33 | Phosphorylation | PyMOL_RFAA | ||
THR | 242 | Phosphorylation | PyMOL_RFAA | ||
SER | 220 | Phosphorylation | PyMOL_RFAA | ||
SER | 239 | Phosphorylation | PyMOL_RFAA | ||
MET | 219 | Sulfoxidation | PyMOL_RFAA | ||
SER | 163 | Phosphorylation | PyMOL_RFAA | ||
MET | 247 | Sulfoxidation | PyMOL_RFAA |