X-ray structure of a Rex-family repressor/NADH complex insights into the mechanism of redox sensing

Structure. 2005 Jan;13(1):43-54. doi: 10.1016/j.str.2004.10.012.

Abstract

The redox-sensing repressor Rex regulates transcription of respiratory genes in response to the intra cellular NADH/NAD(+) redox poise. As a step toward elucidating the molecular mechanism of NADH/NAD(+) sensing, the X-ray structure of Thermus aquaticus Rex (T-Rex) bound to effector NADH has been determined at 2.9 A resolution. The fold of the C-terminal domain of T-Rex is characteristic of NAD(H)-dependent enzymes, whereas the N-terminal domain is similar to a winged helix DNA binding motif. T-Rex dimerization is primarily mediated by "domain-swapped" alpha helices. Each NADH molecule binds to the C-terminal domain near the dimer interface. In contrast to NAD(H)-dependent enzymes, the nicotinamide is deeply buried within a hydrophobic pocket that appears to preclude substrate entry. We show that T-Rex binds to the Rex operator, and NADH but not NAD(+) inhibits T-Rex/DNA binding activity. A mechanism for redox sensing by Rex family members is proposed by analogy with domain closure of NAD(H)-dependent enzymes.

Publication types

  • Comparative Study
  • Research Support, Non-U.S. Gov't
  • Research Support, U.S. Gov't, P.H.S.

MeSH terms

  • Amino Acid Motifs
  • Amino Acid Sequence
  • Binding Sites
  • Conserved Sequence
  • Crystallography, X-Ray*
  • DNA / chemistry
  • DNA / metabolism
  • Dimerization
  • Electrophoretic Mobility Shift Assay
  • Escherichia coli / genetics
  • Gene Products, rex / chemistry
  • Gene Products, rex / genetics*
  • Hydrophobic and Hydrophilic Interactions
  • Models, Molecular
  • Molecular Sequence Data
  • NAD / metabolism*
  • Operon
  • Oxidation-Reduction
  • Protein Conformation
  • Protein Structure, Secondary
  • Protein Structure, Tertiary
  • Repressor Proteins / chemistry
  • Repressor Proteins / genetics
  • Repressor Proteins / isolation & purification
  • Repressor Proteins / metabolism*
  • Sequence Homology, Amino Acid
  • Surface Plasmon Resonance
  • Thermus / chemistry

Substances

  • Gene Products, rex
  • Repressor Proteins
  • NAD
  • DNA

Associated data

  • PDB/1XCB