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April 19, 2026Journal of Biomolecular Structure and Dynamics0 citations

Modelling the structure of Lsi2, Lsi3, Lsi6 proteins and their role in the intercellular trafficking of silicon from root to shoot in rice

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NSNadir SepayACArgha ChakrabortyNSNayim Sepay

Key Points

  • This research aims to understand the structures of Lsi2, Lsi3, and Lsi6 proteins and their roles in silicon transport in rice.
  • Conducted structural analysis of Lsi2, Lsi3, and Lsi6 proteins using AlphaFold2.
  • Performed molecular dynamics simulations over 200 ns to study protein behavior.
  • Used quantitative real-time PCR to assess OsLsi3 gene expression in rice roots.
  • Conducted spectrophotometric analysis to measure silicon content in various plant tissues.
  • Revealed α-helix composition and heterogeneous silicon transport sites in Lsi2, Lsi3, and Lsi6.
  • Identified that Lsi1 and Lsi6 have highly comparable structures, while Lsi2 and Lsi3 show significant similarities.
  • Showed strong OsLsi3 gene expression in rice roots, indicating its key role in silicon transport.
  • Detected significant variations in silicon content with the root having the highest concentration around ∼415 nm.

Abstract

Opaline silica bodies (phytoliths) are found in plants, particularly grasses, and primarily contribute to plant strength and protection. They form from silicic acid, which is transported from the soil to the leaves - a process that is still being researched. Key transmembrane proteins involved in this transport are Lsi1, Lsi2, Lsi3, and Lsi6, with Lsi1 being the most well understood. Our study focuses on determining the structures of Lsi2, Lsi3, and Lsi6 in rice, revealing an α-helix composition and heterogeneous silicon transport sites, with findings validated using AlphaFold2. Lsi1 and Lsi6 share highly comparable structures, while Lsi2 and Lsi3 also show significant structural similarities. Previous research has shown that in certain regions, the pore sizes of Lsi1 proteins are smaller than Si(OH)4, facilitating effective silicic acid transport through hydrogen bonding with amino acids. Molecular dynamics (MD) simulations over 200 ns demonstrate that this hydrogen bonding enhances the transport of Si(OH)4 during protein conformational changes. Using quantitative real-time PCR (qRT-PCR), the OsLsi3 gene was expressed most strongly in the root, in both wild and cultivated rice plants. Spectrophotometric analysis revealed significant variations in silicon content across different tissues, with the root displaying the highest intensity around ∼ 415 nm, indicating greater silicon concentration. Together, these structural, expression, and compositional analyses provide new insights into the organisation and potential functional roles of silicon transporters in rice. Our research paves the way for improving secure and sustainable rice yield through the precise manipulation of the selectivity of Lsi2, Lsi3, and Lsi6.

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Cite This Study

Sepay et al. (2026) studied this question.

synapsesocial.com/papers/69e470a4010ef96374d8d900https://doi.org/10.1080/07391102.2026.2653797
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