Literature DB >> 34732893

Few-fs resolution of a photoactive protein traversing a conical intersection.

A Hosseinizadeh1, N Breckwoldt2,3,4, R Fung1, R Sepehr1, M Schmidt1, P Schwander1, R Santra2,3,4, A Ourmazd5.   

Abstract

The structural dynamics of a molecule are determined by the underlying potential energy landscape. Conical intersections are funnels connecting otherwise separate potential energy surfaces. Posited almost a century ago1, conical intersections remain the subject of intense scientific interest2-5. In biology, they have a pivotal role in vision, photosynthesis and DNA stability6. Accurate theoretical methods for examining conical intersections are at present limited to small molecules. Experimental investigations are challenged by the required time resolution and sensitivity. Current structure-dynamical understanding of conical intersections is thus limited to simple molecules with around ten atoms, on timescales of about 100 fs or longer7. Spectroscopy can achieve better time resolutions8, but provides indirect structural information. Here we present few-femtosecond, atomic-resolution videos of photoactive yellow protein, a 2,000-atom protein, passing through a conical intersection. These videos, extracted from experimental data by machine learning, reveal the dynamical trajectories of de-excitation via a conical intersection, yield the key parameters of the conical intersection controlling the de-excitation process and elucidate the topography of the electronic potential energy surfaces involved.
© 2021. The Author(s), under exclusive licence to Springer Nature Limited.

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Year:  2021        PMID: 34732893     DOI: 10.1038/s41586-021-04050-9

Source DB:  PubMed          Journal:  Nature        ISSN: 0028-0836            Impact factor:   49.962


  4 in total

Review 1.  Light-Induced Ultrafast Molecular Dynamics: From Photochemistry to Optochemistry.

Authors:  Hui Li; Xiaochun Gong; Hongcheng Ni; Peifen Lu; Xiao Luo; Jin Wen; Youjun Yang; Xuhong Qian; Zhenrong Sun; Jian Wu
Journal:  J Phys Chem Lett       Date:  2022-06-22       Impact factor: 6.888

2.  Electronic coherences in nonadiabatic molecular photophysics revealed by time-resolved photoelectron spectroscopy.

Authors:  Stefano M Cavaletto; Daniel Keefer; Shaul Mukamel
Journal:  Proc Natl Acad Sci U S A       Date:  2022-03-07       Impact factor: 12.779

3.  Dynamics retrieval from stochastically weighted incomplete data by low-pass spectral analysis.

Authors:  Cecilia M Casadei; Ahmad Hosseinizadeh; Gebhard F X Schertler; Abbas Ourmazd; Robin Santra
Journal:  Struct Dyn       Date:  2022-08-16       Impact factor: 3.670

4.  Excited-State Barrier Controls EZ Photoisomerization in p-Hydroxycinnamate Biochromophores.

Authors:  Eleanor K Ashworth; Neville J A Coughlan; W Scott Hopkins; Evan J Bieske; James N Bull
Journal:  J Phys Chem Lett       Date:  2022-09-23       Impact factor: 6.888

  4 in total

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