G-quadruplex vs. duplex-DNA binding of nickel(II) and zinc(II) Schiff base complexes

J Inorg Biochem. 2016 Aug:161:115-21. doi: 10.1016/j.jinorgbio.2016.05.010. Epub 2016 May 14.

Abstract

Novel nickel(II) (1) and zinc(II) (2) complexes of a Salen-like ligand, carrying a pyrimidine ring on the N,N' bridge, were synthesized and characterized. Their interaction with duplex and G-quadruplex DNA was investigated in aqueous solution through UV-visible absorption, circular dichroism and viscometry measurements. The results obtained point out that, while the zinc(II) complex does not interact with both duplex and G-quadruplex DNA, the nickel(II) complex 1 binds preferentially to G-quadruplex respect to duplex-DNA, with values of the DNA-binding constants, Kb, 2.6×10(5)M(-1) and 3.5×10(4)M(-1), respectively. Molecular dynamics simulations provided an atomic level model of the top-stacking binding occurring between 1 and hTelo (a 22-mer sequence oligonucleotide) in G-quadruplex conformation.

Keywords: Binding constant; Circular dichroism; Computational chemistry; DNA G-quadruplex, nickel; zinc.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • DNA / chemistry*
  • G-Quadruplexes*
  • Models, Molecular*
  • Nickel / chemistry*
  • Schiff Bases / chemistry
  • Zinc / chemistry*

Substances

  • Schiff Bases
  • Nickel
  • DNA
  • Zinc