Mechanism of inhibition of DNA gyrase by quinolone antibacterials: a cooperative drug--DNA binding model

Biochemistry. 1989 May 2;28(9):3886-94. doi: 10.1021/bi00435a039.

Abstract

We have proposed a cooperative quinolone-DNA binding model for the inhibition of DNA gyrase. The essential feature of the model is that bound gyrase induces a specific quinolone binding site in the relaxed DNA substrate in the presence of ATP. The binding affinity and specificity are derived from two unique and equally important functional features: the specific conformation of the proposed single-stranded DNA pocket induced by the enzyme and the unique self-association phenomenon (from which the cooperativity is derived) of the drug molecules to fit the binding pocket with a high degree of flexibility. Supporting evidence for and implications of this model are provided.

MeSH terms

  • Anti-Bacterial Agents / pharmacology*
  • DNA / metabolism*
  • DNA, Bacterial / metabolism*
  • Models, Molecular
  • Molecular Conformation
  • Nalidixic Acid / pharmacology
  • Nucleic Acid Conformation
  • Protein Conformation
  • Quinolones / pharmacology*
  • Structure-Activity Relationship
  • Topoisomerase II Inhibitors*

Substances

  • Anti-Bacterial Agents
  • DNA, Bacterial
  • Quinolones
  • Topoisomerase II Inhibitors
  • Nalidixic Acid
  • DNA