Ligand name: 4-[(3-BROMO-4-O-SULFAMOYLBENZYL)(4-CYANOPHENYL)AMINO]-4H-[1,2,4]-TRIAZOLE
PDB ligand accession: 4TR
DrugBank: DB04600
PubChem: 4369414
ChEMBL: CHEMBL108483
InChI Key: GHDKYBCUDPSXGJ-UHFFFAOYSA-N
SMILES: NS(=O)(=O)OC1=CC=C(CN(N2C=NN=C2)C2=CC=C(C=C2)C#N)C=C1Br
Drug action: n/a

List of small molecule binding-associated PTMs for P00918

Residue UniProt number Type of PTM AlphaFold3 models Rosetta models Chai-1 models
SER 29 Phosphorylation PyMOL_RFAA