PDB ligand accession: TTP
DrugBank: DB02452
PubChem:
ChEMBL:
InChI Key: NHVNXKFIZYSCEB-XLPZGREQSA-N
SMILES: CC1=CN([C@H]2C[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O2)C(=O)NC1=O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
CYS | 189 | Glutathionylation | PyMOL_RFAA | ||
SER | 84 | Phosphorylation | PyMOL_RFAA | ||
THR | 108 | Phosphorylation | PyMOL_RFAA | ||
THR | 111 | Phosphorylation | PyMOL_RFAA | ||
TYR | 112 | Phosphorylation | PyMOL_Chai1 | ||
THR | 116 | Phosphorylation | PyMOL_RFAA | ||
TYR | 99 | Phosphorylation | PyMOL_Chai1 |