Binding of a new Ca2+ sensitizer, levosimendan, to recombinant human cardiac troponin C. A molecular modelling, fluorescence probe, and proton nuclear magnetic resonance study

J Biol Chem. 1994 Nov 18;269(46):28584-90.

Abstract

The binding of a new calcium sensitizer, levosimendan, to human cardiac troponin C (cTnC) is described. Fluorescence studies done on dansylated recombinant human cTnC and a site-directed mutant showed that levosimendan modulated the calcium-induced conformational change in cTnC, and revealed the role of Asp-88 in the binding of the drug to the NH2-terminal domain of cTnC. Furthermore, NMR studies performed on the NH2-terminal fragment of cTnC showed a spatial proximity between levosimendan and Met81, Met85, and Phe77 in the drug-protein complex. These data were used to build an optimized model of the drug-protein complex, in which levosimendan binds cTnC at the hydrophobic pocket of the NH2-terminal domain. The role of the binding of levosimendan to cTnC in the pharmacological action of this drug in vivo is discussed.

MeSH terms

  • Base Sequence
  • Calcium / metabolism*
  • Cardiotonic Agents / metabolism*
  • DNA Primers
  • Escherichia coli / genetics
  • Fluorescent Dyes
  • Humans
  • Hydrazones / metabolism*
  • Magnetic Resonance Spectroscopy
  • Models, Molecular
  • Molecular Sequence Data
  • Myocardium / metabolism*
  • Protein Binding
  • Protons
  • Pyridazines / metabolism*
  • Recombinant Proteins / genetics
  • Recombinant Proteins / metabolism
  • Simendan
  • Troponin / genetics
  • Troponin / metabolism*
  • Troponin C

Substances

  • Cardiotonic Agents
  • DNA Primers
  • Fluorescent Dyes
  • Hydrazones
  • Protons
  • Pyridazines
  • Recombinant Proteins
  • Troponin
  • Troponin C
  • Simendan
  • Calcium