Trypsin inhibition by macrocyclic and open-chain variants of the squash inhibitor MCoTI-II

Biol Chem. 2005 Dec;386(12):1301-6. doi: 10.1515/BC.2005.148.

Abstract

MCoTI-I and MCoTI-II from the seeds of Momordica cochinchinensis are inhibitors of trypsin-like proteases and the only known members of the large family of squash inhibitors that are cyclic and contain an additional loop connecting the amino- and the carboxy-terminus. To investigate the contribution of macrocycle formation to biological activity, we synthesized a set of open-chain variants of MCoTI-II that lack the cyclization loop and contain various natural and non-natural amino acid substitutions in the reactive-site loop. Upon replacement of P1 lysine residue #10 within the open-chain variant of MCoTI-II by the non-natural isosteric nucleo amino acid AlaG [beta-(guanin-9-yl)-L-alanine], a conformationally restricted arginine mimetic, residual inhibitory activity was detected, albeit reduced by four orders of magnitude. While the cyclic inhibitors MCoTI-I and MCoTI-II were found to be very potent trypsin inhibitors, with picomolar inhibition constants, the open-chain variants displayed an approximately 10-fold lower affinity. These data suggest that the formation of a circular backbone in the MCoTI squash inhibitors results in enhanced affinity and therefore is a determinant of biological activity.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Alanine / chemistry
  • Amino Acid Sequence
  • Arginine / chemistry
  • Chromogranins / chemistry
  • Cucurbitaceae / enzymology*
  • Cyclization
  • Cyclotides / chemical synthesis*
  • Cyclotides / pharmacology
  • Lysine / chemistry
  • Molecular Mimicry
  • Molecular Sequence Data
  • Protein Conformation
  • Trypsin / metabolism*

Substances

  • Chromogranins
  • Cyclotides
  • beta-granins
  • trypsin inhibitor MCoTI-II
  • Arginine
  • Trypsin
  • Lysine
  • Alanine