PDB ligand accession: BTN
DrugBank: DB00121
PubChem:
ChEMBL:
InChI Key: YBJHBAHKTGYVGT-ZKWXMUAHSA-N
SMILES: [H][C@]12CS[C@@H](CCCCC(O)=O)[C@@]1([H])NC(=O)N2
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 1090 | Acetylation | |||
THR | 513 | Phosphorylation | |||
THR | 514 | Phosphorylation | |||
TYR | 503 | Phosphorylation | PyMOL_RFAA | ||
LYS | 1090 | Succinylation | |||
LYS | 1144 | Biotinylation | PyMOL_Chai1 | ||
LYS | 1144 | Lipoylation | |||
TYR | 118 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 |