PDB ligand accession: AM8
DrugBank: DB07369
PubChem:
ChEMBL: n/a
InChI Key: YMJLSOJLEXWATP-UHFFFAOYSA-N
SMILES: CN(C1=CC(Cl)=CC=C1)S(=O)(=O)C1=CC2=C(CC3=C(C)C(C)=C(C)N3)C(=O)N=C2C=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 1110 | Acetylation | PyMOL_RFAA | ||
TYR | 1093 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
TYR | 1230 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
TYR | 1235 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
LYS | 1161 | Ubiquitination | |||
LYS | 1232 | Ubiquitination |