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学術論文

Decrypting cryptochrome: revealing the molecular identity of the photoactivation reaction

MPS-Authors
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Domratcheva,  Tatiana
Department of Biomolecular Mechanisms, Max Planck Institute for Medical Research, Max Planck Society;

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Moughal Shahi,  Abdul Rehaman
Department of Biomolecular Mechanisms, Max Planck Institute for Medical Research, Max Planck Society;

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http://dx.doi.org/10.1021/ja3074819
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引用

Solov'yov, I. A., Domratcheva, T., Moughal Shahi, A. R., & Schulten, K. (2012). Decrypting cryptochrome: revealing the molecular identity of the photoactivation reaction. Journal of the American Chemical Society, 134(43), 18046-18052. doi:10.1021/ja3074819.


引用: https://hdl.handle.net/11858/00-001M-0000-0024-1F97-4
要旨
Migrating birds fly thousands of miles or more, often without visual cues and in treacherous winds, yet keep direction. They employ for this purpose, apparently as a powerful navigational tool, the photoreceptor protein cryptochrome to sense the geomagnetic field. The unique biological function of cryptochrome supposedly arises from a photoactivation reaction involving radical pair formation through electron transfer. Radical pairs, indeed, can act as a magnetic compass; however, the cryptochrome photoreaction pathway is not fully resolved yet. To reveal this pathway and underlying photochemical mechanisms, we carried out a combination of quantum chemical calculations and molecular dynamics simulations on plant (Arabidopsis thaliana) cryptochrome. The results demonstrate that after photoexcitation a radical pair forms, becomes stabilized through proton transfer, and decays back to the protein's resting state on time scales allowing the protein, in principle, to act as a radical pair−based magnetic sensor. We briefly relate our findings on A. thaliana cryptochrome to photoreaction pathways in animal cryptochromes