Ligand name: tert-butanol
PDB ligand accession: TBU
DrugBank: DB03900
PubChem: 6386
ChEMBL: CHEMBL16502
InChI Key: DKGAVHZHDRPRBM-UHFFFAOYSA-N
SMILES: CC(C)(C)O
Drug action: n/a

List of small molecule binding-associated PTMs for P50579

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
CYS 436 S-nitrosylation PyMOL_RFAA
MET 378 Sulfoxidation PyMOL_RFAA
MET 384 Sulfoxidation PyMOL_RFAA
CYS 263 Glutathionylation PyMOL_RFAA
LYS 281 Ubiquitination