PDB ligand accession: ADW
DrugBank: DB02183
PubChem: n/a
ChEMBL: n/a
InChI Key: OIACDJFRUAAXOT-UHFFFAOYSA-K
SMILES: NC1=C2N=CN(C3OC(CO[W](O)(=O)O[W](O)(O)=O)C(O)C3O)C2=NC=N1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 21 | Acetylation | PyMOL_Chai1 | ||
LYS | 30 | Acetylation | PyMOL_Chai1 | ||
LYS | 21 | Malonylation | |||
LYS | 30 | Malonylation | |||
LYS | 21 | Methylation | PyMOL_Chai1 PyMOL_Chai1 PyMOL_Chai1 PyMOL_Chai1 | ||
SER | 45 | Phosphorylation | PyMOL_Chai1 | ||
SER | 102 | Phosphorylation | PyMOL_Chai1 | ||
SER | 107 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 109 | Phosphorylation | PyMOL_Chai1 | ||
MET | 96 | Sulfoxidation | PyMOL_Chai1 | ||
LYS | 21 | Ubiquitination | |||
LYS | 30 | Ubiquitination |