Ligand name: (3r)-4-(P-Toluenesulfonyl)-1,4-Thiazane-3-Carboxylicacid-L-Leucine
PDB ligand accession: TST
DrugBank: DB04012
PubChem: 446411
ChEMBL: n/a
InChI Key: GFEHACHKMVZGNQ-HOTGVXAUSA-N
SMILES: [H][C@@](CC(C)C)(NC(=O)[C@]1([H])CSCCN1S(=O)(=O)C1=CC=C(C)C=C1)C(O)=O
Drug action: n/a

List of small molecule binding-associated PTMs for P62942

Residue	UniProt number	Type of PTM	AlphaFold3 models	Rosetta models	Chai-1 models
LYS	36	Acetylation		PyMOL_RFAA
LYS	48	Acetylation		PyMOL_RFAA
LYS	53	Acetylation		PyMOL_RFAA
CYS	23	Glutathionylation		PyMOL_RFAA
LYS	48	Malonylation		PyMOL_RFAA
LYS	53	Malonylation		PyMOL_RFAA
TYR	81	Phosphorylation			PyMOL_Chai1
MET	30	Sulfoxidation		PyMOL_RFAA
LYS	53	Ubiquitination