Oral Presentation 18th International Congress on Photobiology 2024

From color-tuning to optogenetics: relationship between red-light absorption and fluorescence intensity in an archaerhodopsin model. (#47)

Massimo Olivucci 1
  1. University of Siena and Bowling Green State University, Siena, ITALY, Italy

Recent computational studies have revealed the critical impact of the electronic structure of the excited state species generated during the light-induced double bond isomerization of the chromophore of rhodopsin pigments. While a charge transfer structure dominates the function of visual rhodopsins (1), a diradical structure appears to control the fluorescence emission in NeoRhodopsin (3,4) and in a set of archaearhodopsin optogenetic reporters (2). By using a novel and unconventional type of quantum chemical modeling, we show that the stability of such a diradical must be inversely proportional to the absorption wavelength and that, most importantly, both properties can be regulated by the position and “delocalization” of the counter-ion of the protonated retinal chromophore.

  1. (1) X. Yang et al., Nat. Chem. 2022, 14, 441-449.
  2. (2) L. Barneschi et al., Nat. Comm. 2022, 13, 6432.
  3. (3) R. Palombo et al., Nat. Comm.  2022, 13, 6652.
  4. (4) Broser, M. et al. J. Phys. Chem. Lett. 2023, 14, 9291.