Ligand name: 1-[(2-NITROPHENYL)SULFONYL]-1H-PYRROLO[3,2-B]PYRIDINE-6-CARBOXAMIDE
PDB ligand accession: ZZY
DrugBank: DB08791
PubChem: 25229537
ChEMBL: CHEMBL561660
InChI Key: USLOIFPDNUDIEG-UHFFFAOYSA-N
SMILES: NC(=O)C1=CN=C2C=CN(C2=C1)S(=O)(=O)C1=CC=CC=C1[N+]([O-])=O
Drug action: n/a

List of small molecule binding-associated PTMs for P08581

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
LYS 1110 Acetylation PyMOL_RFAA
TYR 1093 Phosphorylation PyMOL_RFAA PyMOL_Chai1
TYR 1230 Phosphorylation PyMOL_RFAA PyMOL_Chai1
TYR 1235 Phosphorylation PyMOL_RFAA PyMOL_Chai1
LYS 1161 Ubiquitination