Sequence specific recognition of DNA by tailor-made hairpin conjugates of achiral seco-cyclopropaneindoline-2-benzofurancarboxamide and pyrrole-imidazole polyamides

Bioorg Med Chem Lett. 2005 Jun 15;15(12):3151-6. doi: 10.1016/j.bmcl.2005.04.006.

Abstract

Hairpin conjugates of achiral seco-cyclopropaneindoline-2-benzofurancarboxamide (achiral seco-CI-Bf) and three diamides (ImPy 1, PyIm 2, and PyPy 3, where Py is pyrrole, and Im is imidazole), linked by a gamma-aminobutyrate group, were synthesized. The sequence-specific covalent alkylation of the achiral CI moiety with adenine-N3 in the minor groove was ascertained by thermally induced DNA cleavage experiments. The results provide evidence that hairpin conjugates of achiral seco-CI-Bf-gamma-polyamides could be tailored to target specific DNA sequences according to a set of general rules: the achiral CI moiety selectively reacts with adenine-N3, a stacked pair of imidazole/benzofuran prefers a G/C base pair, and a pyrrole/benzofuran prefers an A/T or T/A base pair. Models for the binding of hairpin conjugates 1-3 with sequences 5'-TCA(888)G-3', 5'-CAA(857)C-3', and 5'-TTA(843)C-3' are proposed.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • AT Rich Sequence / physiology
  • Amides / chemistry
  • Amides / metabolism*
  • Antigens, Neoplasm / genetics
  • Antigens, Neoplasm / metabolism
  • Benzofurans / chemistry
  • Benzofurans / metabolism*
  • Binding Sites
  • DNA / genetics*
  • DNA / metabolism*
  • DNA / radiation effects
  • DNA Topoisomerases, Type II / genetics
  • DNA Topoisomerases, Type II / metabolism
  • DNA-Binding Proteins / genetics
  • DNA-Binding Proteins / metabolism
  • GC Rich Sequence / physiology
  • Hot Temperature
  • Imidazoles / chemistry*
  • Molecular Conformation
  • Nucleic Acid Conformation
  • Promoter Regions, Genetic / genetics
  • Pyrroles / chemistry*
  • Substrate Specificity
  • Thermodynamics

Substances

  • Amides
  • Antigens, Neoplasm
  • Benzofurans
  • DNA-Binding Proteins
  • Imidazoles
  • Pyrroles
  • DNA
  • DNA Topoisomerases, Type II