A clamp-like orientation of basic residues set in a parallelogram is essential for heparin binding

FEBS Lett. 2016 Sep;590(18):3089-97. doi: 10.1002/1873-3468.12361. Epub 2016 Aug 31.

Abstract

While the majority of studies have focused on the biological roles of heparin-binding proteins, relatively little is known about their key residues and structural elements responsible for heparin interaction. In this study, we employed the IgG-binding domain B1 of Streptococcal protein G as a miniature scaffold to investigate how certain positively charged residues within the β-sheet conformation become favorable for heparin binding. By performing a series of arginine substitution mutations followed by gain-of-heparin-binding analysis, we deduced that a clamp-like orientation with discontinuous basic residues separated by ~ 5 Å with ~ 100° interior angle is advantageous for high heparin affinity.

Keywords: GB1; heparin binding; protein modeling.

Publication types

  • Letter
  • Research Support, Non-U.S. Gov't

MeSH terms

  • Bacterial Proteins / chemistry*
  • Bacterial Proteins / genetics
  • Bacterial Proteins / metabolism
  • Binding Sites
  • Heparin / metabolism*
  • Molecular Dynamics Simulation
  • Mutation
  • Protein Binding

Substances

  • Bacterial Proteins
  • IgG Fc-binding protein, Streptococcus
  • Heparin