PDB ligand accession: BPI
DrugBank: DB07479
PubChem:
ChEMBL: n/a
InChI Key: WCUHTHVUZQCBTI-KBAYOESNSA-N
SMILES: [H][C@@]1(O)CC2=C(C=CC3=C2C2=C(C=CC=C2)C=C3)[C@@]([H])(O)[C@]1([H])O
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
ARG | 258 | Methylation | PyMOL_RFAA PyMOL_RFAA PyMOL_RFAA | ||
SER | 44 | Phosphorylation | PyMOL_RFAA | ||
LYS | 41 | Ubiquitination |