PDB ligand accession: STU
DrugBank: DB02010
PubChem:
ChEMBL:
InChI Key: HKSZLNNOFSGOKW-FYTWVXJKSA-N
SMILES: [H][C@]1(C[C@@]2([H])O[C@](C)(N3C4=CC=CC=C4C4=C5CNC(=O)C5=C5C6=CC=CC=C6N2C5=C34)[C@]1([H])OC)NC
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| LYS | 33 | Acetylation | PyMOL_RFAA | ||
| LYS | 9 | Acetylation | PyMOL_RFAA | ||
| LYS | 20 | Acetylation | PyMOL_RFAA | ||
| THR | 14 | Phosphorylation | PyMOL_RFAA | ||
| TYR | 15 | Phosphorylation | PyMOL_Chai1 | ||
| TYR | 19 | Phosphorylation | PyMOL_Chai1 | ||
| LYS | 9 | Ubiquitination | |||
| LYS | 20 | Ubiquitination | |||
| LYS | 33 | Ubiquitination | |||
| LYS | 129 | Ubiquitination | |||
| LYS | 142 | Ubiquitination | |||
| THR | 158 | Phosphorylation | PyMOL_RFAA | ||
| THR | 165 | Phosphorylation | PyMOL_RFAA | ||
| THR | 160 | Phosphorylation | PyMOL_RFAA | ||
| TYR | 159 | Phosphorylation | PyMOL_Chai1 |