Cryogenic “Iodide-Tagging” Photoelectron Spectroscopy: A Sensitive Probe for Specific Binding Sites of Amino Acids

Zhang, Hanhui; Cao, Wenjin; Yuan, Qinqin; Zhou, Xiaoguo; Valiev, Marat; Kass, Steven R.; Wang, Xue-Bin

doi:10.1021/acs.jpclett.0c01099

Title: Cryogenic “Iodide-Tagging” Photoelectron Spectroscopy: A Sensitive Probe for Specific Binding Sites of Amino Acids

Journal Article · Wed May 13 00:00:00 EDT 2020 · Journal of Physical Chemistry Letters

DOI:https://doi.org/10.1021/acs.jpclett.0c01099· OSTI ID:1639918

Zhang, Hanhui ^[1];

^[2]; Yuan, Qinqin ^[2];

^[3];

^[2];

^[4];

^[2]

Pacific Northwest National Lab. (PNNL), Richland, WA (United States); Univ. of Science and Technology of China, Hefei (China)
Pacific Northwest National Lab. (PNNL), Richland, WA (United States)
Hefei Univ. of Technology (China)
Univ. of Minnesota, Minneapolis, MN (United States)

This work showcases cryogenic and temperature-dependent “iodide-tagging” photoelectron spectroscopy to probe specific binding sites of amino acids using the glycine-iodide complex (Gly?I-) as a case study. Multiple Gly?I- isomers were generated from ambient electrospray ionization and kinetically isolated in a cryogenic ion trap. These structures were characterized with temperature-dependent “iodide-tagging” negative ion photoelectron spectroscopy (NIPES) where iodide was used as the “messenger” to interpret electronic energetics and structural information of various Gly?I- isomers. Accompanied by theoretical computations and Franck-Condon simulations, a total of five cluster structures have been identified along with their various binding motifs. This work demonstrates that “iodide-tagging” NIPES is a powerful general means for probing specific binding interactions in biological molecules of interest.

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Research Organization:: Pacific Northwest National Lab. (PNNL), Richland, WA (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

Grant/Contract Number:: AC05-76RL01830

OSTI ID:: 1639918

Report Number(s):: PNNL-SA-152646; 1948-7185

Journal Information:: Journal of Physical Chemistry Letters, Vol. 11, Issue 11; ISSN 1948-7185

Publisher:: American Chemical SocietyCopyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 11 works

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References (51)

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