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Crystal Structure Reveals the Binding Mode and Selectivity of a Photoswitchable Ligand for the Adenosine A2A Receptor

25 October 2023, Version 1
Working Paper
This content is a preprint and has not undergone peer review at the time of posting.

Abstract

Rational synthetic expansion of photoresponsive ligands is important for photopharmacological studies. In this study, the photoresponsive and receptor-selective ligand, photoNECA(blue), was synthesized for the adenosine A2A receptor, and its crystal structure was determined. This complex structure explains the binding mode and photoresponsive mechanism of photoNECA(blue).

Keywords

Photopharmacology
GPCR
A2A receptor
G protein coupled-receptor
Adenosine receptors

Supplementary materials

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Version History

Oct 25, 2023 Version 1

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The content is available under CC BY NC ND 4.0 [opens in a new tab]

DOI

10.26434/chemrxiv-2023-7q2ht
D O I: 10.26434/chemrxiv-2023-7q2ht [opens in a new tab]

Funding

Research Support Project for Life Science and Drug Discovery (Basis for Supporting Innovative Drug Discovery and Life Science Research (BINDS)) from AMED
JP23ama121001
Research Support Project for Life Science and Drug Discovery (Basis for Supporting Innovative Drug Discovery and Life Science Research (BINDS)) from AMED
JP23ama121007
JSPS Grant-in-Aid for Scientific Research on Innovative Areas
19H05777
JSPS Grant-in-Aid for Scientific Research on Innovative Areas
19H05778
JSPS Grant-in-Aid for Scientific Research on Innovative Areas
19H05781
Kyoto University MIP Interdisciplinary Joint Research grant
JST ERATO Hamachi Innovative Molecular Technology for Neuroscience Project
JPMJER1802
Platform Project for Supporting Drug Discovery and Life Science Research (Basis for Supporting Innovative Drug Discovery and Life Science Research (BINDS)) from AMED
JP21am0101070
Platform Project for Supporting Drug Discovery and Life Science Research (Basis for Supporting Innovative Drug Discovery and Life Science Research (BINDS)) from AMED
JP21am0101079
JSPS Fostering Joint International Research (B)
22KK0099

Author’s competing interest statement

The author(s) have declared they have no conflict of interest with regard to this content

Ethics

The author(s) have declared ethics committee/IRB approval is not relevant to this content

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