Ligand name: 8-Benzo[1,3]Dioxol-,5-Ylmethyl-9-Butyl-2-Fluoro-9h-Purin-6-Ylamine
PDB ligand accession: PUX
DrugBank: DB04254
PubChem: 448976
ChEMBL: CHEMBL109822
InChI Key: ARWHTQLGMWHTAZ-UHFFFAOYSA-N
SMILES: CCCCN1C(CC2=CC3=C(OCO3)C=C2)=NC2=C(N)N=C(F)N=C12
Drug action: n/a

List of small molecule binding-associated PTMs for P07900

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	58	Acetylation		PyMOL_RFAA
LYS	100	Acetylation		PyMOL_RFAA
LYS	112	Acetylation		PyMOL_RFAA
SER	52	Phosphorylation		PyMOL_RFAA
SER	53	Phosphorylation		PyMOL_RFAA
THR	94	Phosphorylation		PyMOL_RFAA
THR	99	Phosphorylation		PyMOL_RFAA
THR	109	Phosphorylation		PyMOL_RFAA
TYR	160	Phosphorylation		PyMOL_RFAA	PyMOL_Chai1
SER	164	Phosphorylation		PyMOL_RFAA
SER	50	Phosphorylation		PyMOL_RFAA
THR	171	Phosphorylation		PyMOL_RFAA
LYS	100	Succinylation		PyMOL_RFAA PyMOL_RFAA
MET	98	Sulfoxidation		PyMOL_RFAA
LYS	58	Ubiquitination
LYS	112	Ubiquitination
LYS	185	Ubiquitination