Ligand name: N'-((2S,3R)-3-AMINO-2-HYDROXY-5-(ISOPROPYLSULFANYL)PENTANOYL)-N-3-CHLOROBENZOYL HYDRAZIDE
PDB ligand accession: AO5
DrugBank: DB07377
PubChem: 448285
ChEMBL: CHEMBL352764
InChI Key: BYBVYIPUGPZRSX-OLZOCXBDSA-N
SMILES: [H][C@@](N)(CCSC(C)C)[C@]([H])(O)C(=O)NNC(=O)C1=CC(Cl)=CC=C1
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
LYS 385 Acetylation PyMOL_RFAA
CYS 263 Glutathionylation PyMOL_RFAA
THR 461 Phosphorylation PyMOL_RFAA
MET 384 Sulfoxidation PyMOL_RFAA