Ligand name: Neflamapimod
PDB ligand accession: 52P
DrugBank: DB07138
PubChem: 3038525
ChEMBL: CHEMBL119385
InChI Key: VEPKQEUBKLEPRA-UHFFFAOYSA-N
SMILES: FC1=CC(F)=C(SC2=NN3C=NC(=O)C(=C3C=C2)C2=C(Cl)C=CC=C2Cl)C=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
LYS	152	Ubiquitination
TYR	35	Phosphorylation			PyMOL_Chai1
SER	37	Phosphorylation		PyMOL_RFAA