Ligand name: 6((S)-3-Benzylpiperazin-1-Yl)-3-(Naphthalen-2-Yl)-4-(Pyridin-4-Yl)Pyrazine
PDB ligand accession: 6NP
DrugBank: DB01988
PubChem: 4369379
ChEMBL: n/a
InChI Key: WFSFNKVFXLIZIY-MHZLTWQESA-N
SMILES: C([C@H]1CN(CCN1)C1=NN=C(C2=CC3=CC=CC=C3C=C2)C(=C1)C1=CC=NC=C1)C1=CC=CC=C1
Drug action: n/a

List of small molecule binding-associated PTMs for Q16539

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	53	Acetylation		PyMOL_RFAA
LYS	152	Acetylation		PyMOL_RFAA
SER	28	Phosphorylation		PyMOL_RFAA
SER	32	Phosphorylation		PyMOL_RFAA
TYR	24	Phosphorylation			PyMOL_Chai1
TYR	35	Phosphorylation			PyMOL_Chai1
SER	37	Phosphorylation		PyMOL_RFAA
LYS	152	Ubiquitination