Biochemistry and Biophysics Reports (Jul 2024)

Micro-second time-resolved X-ray single-molecule internal motions of SARS-CoV-2 spike variants

  • Daisuke Sasaki,
  • Tatsuya Arai,
  • Yue Yang,
  • Masahiro Kuramochi,
  • Wakako Furuyama,
  • Asuka Nanbo,
  • Hiroshi Sekiguchi,
  • Nobuhiro Morone,
  • Kazuhiro Mio,
  • Yuji C. Sasaki

Journal volume & issue
Vol. 38
p. 101712

Abstract

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Single-molecule intramolecular dynamics were successfully measured for three variants of SARS-CoV-2 spike protein, alpha: B.1.1.7, delta: B.1.617, and omicron: B.1.1.529, with a time resolution of 100 μs using X-rays. The results were then compared with respect to the magnitude and directions of motions for the three variants. The largest 3-D intramolecular movement was observed for the omicron variant irrespective of ACE2 receptor binding. A more detailed analysis of the intramolecular motions revealed that the distribution state of intramolecular motion for the three variants was completely different with and without ACE2 receptor binding. The molecular dynamics for the trimeric spike protein of the omicron variant increased when ACE2 binding occurred. At that time, the diffusion constant increased from 71.0 [mrad2/ms] to 91.1 [mrad2/ms].

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