19F NMR spectroscopy monitors ligand binding to recombinantly fluorine-labelled b'x from human protein disulphide isomerase (hPDI)

Org Biomol Chem. 2014 Jun 21;12(23):3808-12. doi: 10.1039/c4ob00699b.

Abstract

We report a protein-observe (19)F NMR-based ligand titration binding study of human PDI b'x with Δ-somatostatin that also emphasises the need to optimise recombinant protein fluorination when using 5- or 6-fluoroindole. This study highlights a recombinant preference for 5-fluoroindole over 6-fluoroindole; most likely due to the influence of fluorine atomic packing within the folded protein structure. Fluorination affords a single (19)F resonance probe to follow displacement of the protein x-linker as ligand is titrated and provides a dissociation constant of 23 ± 4 μM.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Crystallography, X-Ray
  • Electrophoresis, Polyacrylamide Gel
  • Fluorine / chemistry*
  • Humans
  • Ligands
  • Magnetic Resonance Spectroscopy*
  • Protein Disulfide-Isomerases / chemistry*
  • Recombinant Proteins / chemistry*
  • Titrimetry

Substances

  • Ligands
  • Recombinant Proteins
  • Fluorine
  • Protein Disulfide-Isomerases