Ligand name: 8-BENZO[1,3]DIOXOL-,5-YLMETHYL-9-BUTYL-9H-
PDB ligand accession: PU6
DrugBank: DB08436
PubChem: 448968
ChEMBL: CHEMBL326564
InChI Key: JCDXXNIRWRRGBX-UHFFFAOYSA-N
SMILES: CCCCN1C(CC2=CC3=C(OCO3)C=C2)=NC2=C(N)N=CN=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
THR 115 Phosphorylation PyMOL_RFAA
TYR 160 Phosphorylation PyMOL_RFAA PyMOL_Chai1
SER 164 Phosphorylation PyMOL_RFAA
SER 169 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