PDB ligand accession: BBM
DrugBank: DB03115
PubChem:
ChEMBL: n/a
InChI Key: XXSSGBYXSKOLAM-QMMMGPOBSA-N
SMILES: [H]N(OC[C@@H](O)CO)C(=O)C1=CC(Br)=C(F)C(F)=C1N([H])C1=C(F)C=C(I)C=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
SER | 194 | Phosphorylation | PyMOL_RFAA | ||
SER | 212 | Phosphorylation | PyMOL_RFAA | ||
SER | 218 | Phosphorylation | PyMOL_RFAA | ||
LYS | 192 | Ubiquitination | |||
LYS | 205 | Ubiquitination |