Structure of Scots pine defensin 1 by spectroscopic methods and computational modeling

•Three-dimensional structure of PsDef1 was modeled using 5 computational programs.•Structural model was verified experimentally by CD and FTIR spectroscopy.•PsDef1 exists in the temperature-dependent equilibrium between monomers and dimers.•Structural models for PsDef1 dimer were constructed.•The st...

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Veröffentlicht in:	International journal of biological macromolecules 2016-03, Vol.84, p.142-152
Hauptverfasser:	Ermakova, Elena A., Faizullin, Dzhigangir A., Idiyatullin, Bulat Z., Khairutdinov, Bulat I., Mukhamedova, Liya N., Tarasova, Nadezhda B., Toporkova, Yana Y., Osipova, Elena V., Kovaleva, Valentina, Gogolev, Yuri V., Zuev, Yuriy F., Nesmelova, Irina V.
Format:	Artikel
Sprache:	eng
Schlagworte:	Amino Acid Sequence Circular Dichroism Computational modeling Defensin Defensins - chemistry Dimer FTIR Models, Molecular Molecular Sequence Data Pinus sylvestris - chemistry Plant Proteins - chemistry Position-Specific Scoring Matrices Protein Conformation Protein Multimerization Protein Stability Protein Structure, Secondary Proton Magnetic Resonance Spectroscopy Recombinant Proteins Sequence Alignment Spectroscopy, Fourier Transform Infrared Structure
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