Structural and dynamic features of the MutT protein in the recognition of nucleotides with the mutagenic 8-oxoguanine base

J Biol Chem. 2010 Jan 1;285(1):444-52. doi: 10.1074/jbc.M109.066373. Epub 2009 Oct 28.

Abstract

Escherichia coli MutT hydrolyzes 8-oxo-dGTP to 8-oxo-dGMP, an event that can prevent the misincorporation of 8-oxoguanine opposite adenine in DNA. Of the several enzymes that recognize 8-oxoguanine, MutT exhibits high substrate specificity for 8-oxoguanine nucleotides; however, the structural basis for this specificity is unknown. The crystal structures of MutT in the apo and holo forms and in the binary and ternary forms complexed with the product 8-oxo-dGMP and 8-oxo-dGMP plus Mn(2+), respectively, were determined. MutT strictly recognizes the overall conformation of 8-oxo-dGMP through a number of hydrogen bonds. This recognition mode revealed that 8-oxoguanine nucleotides are discriminated from guanine nucleotides by not only the hydrogen bond between the N7-H and Odelta (N119) atoms but also by the syn glycosidic conformation that 8-oxoguanine nucleotides prefer. Nevertheless, these discrimination factors cannot by themselves explain the roughly 34,000-fold difference between the affinity of MutT for 8-oxo-dGMP and dGMP. When the binary complex of MutT with 8-oxo-dGMP is compared with the ligand-free form, ordering and considerable movement of the flexible loops surrounding 8-oxo-dGMP in the binary complex are observed. These results indicate that MutT specifically recognizes 8-oxoguanine nucleotides by the ligand-induced conformational change.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Amino Acid Sequence
  • Apoproteins / chemistry
  • Apoproteins / metabolism
  • Binding Sites
  • Crystallography, X-Ray
  • Deoxyguanine Nucleotides / metabolism
  • Escherichia coli / enzymology*
  • Escherichia coli Proteins / chemistry*
  • Escherichia coli Proteins / metabolism*
  • Guanine / analogs & derivatives*
  • Guanine / metabolism
  • Metals / metabolism
  • Models, Molecular
  • Molecular Sequence Data
  • Mutagenesis / genetics*
  • Nucleotides / metabolism*
  • Protein Structure, Secondary
  • Pyrophosphatases / chemistry*
  • Pyrophosphatases / metabolism*
  • Sequence Alignment
  • Structure-Activity Relationship
  • Substrate Specificity

Substances

  • Apoproteins
  • Deoxyguanine Nucleotides
  • Escherichia coli Proteins
  • Metals
  • Nucleotides
  • 8-hydroxyguanine
  • Guanine
  • Pyrophosphatases
  • mutT protein, E coli

Associated data

  • PDB/3A6S
  • PDB/3A6T
  • PDB/3A6U
  • PDB/3A6V