Protein Configuration Landscape Fluctuations Revealed by Exciton Transition Polarizations in Single Light Harvesting Complexes

2016 ◽  
Vol 120 (4) ◽  
pp. 724-732 ◽  
Author(s):  
Sumera Tubasum ◽  
Magne Torbjörnsson ◽  
Dheerendra Yadav ◽  
Rafael Camacho ◽  
Gustaf Söderlind ◽  
...  
2021 ◽  
Vol 22 (18) ◽  
pp. 10031
Author(s):  
Roman Y. Pishchalnikov ◽  
Denis D. Chesalin ◽  
Andrei P. Razjivin

Considering bacteriochlorophyll molecules embedded in the protein matrix of the light-harvesting complexes of purple bacteria (known as LH2 and LH1-RC) as examples of systems of interacting pigment molecules, we investigated the relationship between the spatial arrangement of the pigments and their exciton transition moments. Based on the recently reported crystal structures of LH2 and LH1-RC and the outcomes of previous theoretical studies, as well as adopting the Frenkel exciton Hamiltonian for two-level molecules, we performed visualizations of the LH2 and LH1 exciton transition moments. To make the electron transition moments in the exciton representation invariant with respect to the position of the system in space, a system of pigments must be translated to the center of mass before starting the calculations. As a result, the visualization of the transition moments for LH2 provided the following pattern: two strong transitions were outside of LH2 and the other two were perpendicular and at the center of LH2. The antenna of LH1-RC was characterized as having the same location of the strongest moments in the center of the complex, exactly as in the B850 ring, which actually coincides with the RC. Considering LH2 and LH1 as supermolecules, each of which has excitation energies and corresponding transition moments, we propose that the outer transitions of LH2 can be important for inter-complex energy exchange, while the inner transitions keep the energy in the complex; moreover, in the case of LH1, the inner transitions increased the rate of antenna-to-RC energy transfer.


2021 ◽  
Vol 3 (2) ◽  
pp. 262-271
Author(s):  
Pablo Reséndiz-Vázquez ◽  
Ricardo Román-Ancheyta ◽  
Roberto León-Montiel

Transport phenomena in photosynthetic systems have attracted a great deal of attention due to their potential role in devising novel photovoltaic materials. In particular, energy transport in light-harvesting complexes is considered quite efficient due to the balance between coherent quantum evolution and decoherence, a phenomenon coined Environment-Assisted Quantum Transport (ENAQT). Although this effect has been extensively studied, its behavior is typically described in terms of the decoherence’s strength, namely weak, moderate or strong. Here, we study the ENAQT in terms of quantum correlations that go beyond entanglement. Using a subsystem of the Fenna–Matthews–Olson complex, we find that discord-like correlations maximize when the subsystem’s transport efficiency increases, while the entanglement between sites vanishes. Our results suggest that quantum discord is a manifestation of the ENAQT and highlight the importance of beyond-entanglement correlations in photosynthetic energy transport processes.


2021 ◽  
Author(s):  
Vincenzo Mascoli ◽  
Nicoletta Liguori ◽  
Lorenzo Cupellini ◽  
Eduard Elias ◽  
Benedetta Mennucci ◽  
...  

Carotenoids are essential constituents of plant light-harvesting complexes (LHCs), being involved in protein stability, light harvesting, and photoprotection. Unlike chlorophylls, whose binding to LHCs is known to require coordination of...


2019 ◽  
Vol 10 (42) ◽  
pp. 9650-9662 ◽  
Author(s):  
Felipe Cardoso Ramos ◽  
Michele Nottoli ◽  
Lorenzo Cupellini ◽  
Benedetta Mennucci

The spectral tuning of LH2 antenna complexes arises from H-bonding, acetyl torsion, and inter-chromophore couplings.


Science ◽  
2013 ◽  
Vol 340 (6139) ◽  
pp. 1448-1451 ◽  
Author(s):  
R. Hildner ◽  
D. Brinks ◽  
J. B. Nieder ◽  
R. J. Cogdell ◽  
N. F. van Hulst

1999 ◽  
Author(s):  
Carsten Tietz ◽  
Alexander Draebenstedt ◽  
Joerg Schuster ◽  
Joerg Wrachtrup

2015 ◽  
Vol 17 (38) ◽  
pp. 25629-25641 ◽  
Author(s):  
Xiaoqing Wang ◽  
Gerhard Ritschel ◽  
Sebastian Wüster ◽  
Alexander Eisfeld

We elucidate the difference between various parameter extraction methods and demonstrate sensitivity to molecular dynamics equilibration.


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