PDB ligand accession: 685
DrugBank: DB07194
PubChem:
ChEMBL:
InChI Key: PEGXADGTBNRSGV-ZDUSSCGKSA-N
SMILES: [H][C@](C)(CO)NC(=O)C1=C(C)N=C(S1)C1=NC(NC2=CC(C)=CC(C)=C2)=NC=C1
Drug action: n/a
Residue | UniProt number | Type of PTM | AlphaFold3 models | Rosetta models | Chai-1 models |
---|---|---|---|---|---|
LYS | 402 | Acetylation | PyMOL_RFAA | PyMOL_Chai1 | |
SER | 379 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 | |
THR | 384 | Phosphorylation | PyMOL_RFAA | PyMOL_Chai1 |