PDB ligand accession: CBH
DrugBank: DB02337
PubChem:
ChEMBL: n/a
InChI Key: BMONDXDFXRPNKQ-ZETCQYMHSA-N
SMILES: N[C@@H](CCSCCCCC(O)=O)C(O)=O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
THR | 45 | Phosphorylation | PyMOL_RFAA | ||
THR | 73 | Phosphorylation | PyMOL_RFAA | ||
THR | 75 | Phosphorylation | PyMOL_RFAA | ||
TYR | 77 | Phosphorylation | PyMOL_Chai1 |