PDB ligand accession: SX8
DrugBank: DB06314
PubChem:
ChEMBL:
InChI Key: BCZUAADEACICHN-UHFFFAOYSA-N
SMILES: CN1C=C(C=N1)C1=NN2C(SC3=CC=C4N=CC=CC4=C3)=NN=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 | |
LYS | 1161 | Ubiquitination |