Ligand name: 2-[3-chloro-6-[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]imino-1-hydroxypyridin-2-yl]-N-[(1R)-1-(3-chlorophenyl)ethyl]acetamide
PDB ligand accession: L17
DrugBank: DB04722
PubChem: n/a
ChEMBL: n/a
InChI Key: QNBCEVFVDCKHNZ-AZZXOVNPSA-N
SMILES: C[C@@H](NC(=O)CC1=C(Cl)C=C\C(=N/CC(F)(F)C2=CC=CC=[N+]2[O-])N1O)C1=CC(Cl)=CC=C1
Drug action: n/a

List of small molecule binding-associated PTMs for P00734

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 599 Acetylation PyMOL_Chai1
SER 539 Phosphorylation PyMOL_Chai1
THR 540 Phosphorylation PyMOL_Chai1