PDB ligand accession: IXM
DrugBank: DB02052
PubChem: n/a
ChEMBL:
InChI Key: HBDSHCUSXQATPO-BGBJRWHRSA-N
SMILES: O\N=C1\C(\NC2=C\1C=CC=C2)=C1\C(=O)NC2=C1C=CC=C2
Drug action: n/a
| Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
|---|---|---|---|---|---|
| LYS | 9 | Acetylation | PyMOL_RFAA | ||
| LYS | 33 | Acetylation | PyMOL_RFAA | ||
| LYS | 20 | Acetylation | PyMOL_RFAA | ||
| LYS | 9 | Malonylation | PyMOL_RFAA | ||
| TYR | 15 | Phosphorylation | |||
| THR | 17 | Phosphorylation | PyMOL_RFAA | ||
| LYS | 128 | Ubiquitination | |||
| LYS | 141 | Ubiquitination |