PDB ligand accession: BTI
DrugBank: DB07497
PubChem:
ChEMBL: n/a
InChI Key: ARDNWGMSCXSPBF-CIUDSAMLSA-N
SMILES: [H]N1C(=O)N([H])[C@]2([H])[C@H](CCCCC=O)SC[C@]12[H]
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 1144 | Biotinylation | PyMOL_Chai1 | ||
LYS | 1144 | Lipoylation | |||
THR | 514 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 894 | Phosphorylation | PyMOL_Chai1 | ||
SER | 576 | Phosphorylation | PyMOL_Chai1 | ||
THR | 580 | Phosphorylation | PyMOL_Chai1 | ||
LYS | 741 | Carboxylation |