PDB ligand accession: FMD
DrugBank: DB03737
PubChem:
ChEMBL:
InChI Key: RAKYKJWUUUKCCW-MPLBGYFPSA-N
SMILES: [H][C@](C)(O)[C@]([H])(N)[C@]([H])(O)C#CC1=C(F)C=CC2=C1\C(=C\C1=C(OC)C=CN1)C(=O)N2
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 33 | Acetylation | PyMOL_RFAA | ||
LYS | 9 | Acetylation | PyMOL_RFAA | ||
LYS | 20 | Acetylation | PyMOL_RFAA | ||
THR | 14 | Phosphorylation | PyMOL_RFAA | ||
TYR | 15 | Phosphorylation | PyMOL_Chai1 | ||
TYR | 19 | Phosphorylation | PyMOL_Chai1 | ||
THR | 165 | Phosphorylation | PyMOL_RFAA | ||
LYS | 9 | Ubiquitination | |||
LYS | 20 | Ubiquitination | |||
LYS | 33 | Ubiquitination | |||
LYS | 129 | Ubiquitination | |||
LYS | 142 | Ubiquitination |