Measuring electric fields in biological matter using the vibrational Stark effect of nitrile probes

JD Slocum, LJ Webb - Annual Review of Physical Chemistry, 2018 - annualreviews.org
Measurement of the electrostatic interactions that give rise to biological functions has been a
longstanding challenge in biophysics. Advances in spectroscopic techniques over the past …

Unified model for photophysical and electro-optical properties of green fluorescent proteins

CY Lin, MG Romei, LM Oltrogge… - Journal of the …, 2019 - ACS Publications
Green fluorescent proteins (GFPs) have become indispensable imaging and optogenetic
tools. Their absorption and emission properties can be optimized for specific applications …

Measurement of electric fields experienced by urea guest molecules in the 18-Crown-6/urea (1: 5) host–guest complex: An experimental reference point for electric …

MW Shi, SP Thomas, VR Hathwar… - Journal of the …, 2019 - ACS Publications
High-resolution synchrotron and neutron single-crystal diffraction data of 18-crown-
6/(pentakis) urea measured at 30 K are combined, with the aim of better appreciating the …

Solvatochromic and Acid–Base Molecular Probes in Surfactant Micelles: Comparison of Molecular Dynamics Simulation with the Experiment

NO Mchedlov-Petrossyan, VS Farafonov, AV Lebed - Liquids, 2023 - mdpi.com
This article summarizes a series of seventeen publications by the authors devoted to
molecular dynamics modeling of various indicator dyes (molecular probes) enclosed in …

Understanding cysteine reactivity in protein environments with electric fields

V Vaissier Welborn - The Journal of Physical Chemistry B, 2023 - ACS Publications
The role cysteine residues play in proteins is mediated by their protonation state, whereby
the thiolate form of the side chain is highly reactive while the thiol form is more inert …

Molecular dynamics force field parameters for the EGFP chromophore and some of its analogues

KL Breyfogle, DL Blood, AM Rosnik… - The Journal of Physical …, 2023 - ACS Publications
Fluorescent proteins (FPs) have had an enormous impact on molecular and cellular biology
and are employed in a wide range of studies of molecular structure and dynamics. Yet, only …

Quantitative measurement of intrinsic GTP hydrolysis for carcinogenic glutamine 61 mutants in H-Ras

ET Novelli, JT First, LJ Webb - Biochemistry, 2018 - ACS Publications
Mutations of human oncoprotein p21H-Ras (hereafter “Ras”) at glutamine 61 are known to
slow the rate of guanosine triphosphate (GTP) hydrolysis and transform healthy cells into …

Quantifying the effects of hydrogen bonding on nitrile frequencies in GFP: beyond solvent exposure

JT First, JD Slocum, LJ Webb - The Journal of Physical Chemistry …, 2018 - ACS Publications
Vibrational spectroscopy is a powerful tool for characterizing the complex noncovalent
interactions that arise in biological systems. The nitrile stretching frequency has proven to be …

Electroabsorption and Stark fluorescence spectroscopies of Thioflavin T

A Islam, Y Kikuchi, T Iimori - The Journal of Physical Chemistry A, 2023 - ACS Publications
Thioflavin T (ThT) is a typical fluorescent marker for detecting the formation of amyloid fibrils,
because its fluorescence intensity increases by more than 2 orders of magnitude upon …

Rethinking vibrational stark spectroscopy: Peak shifts, line widths, and the role of non-stark solvent coupling

SM Fica-Contreras, AP Charnay, J Pan… - The Journal of …, 2023 - ACS Publications
A vibration's transition frequency is partly determined by the first-order Stark effect, which
accounts for the electric field experienced by the mode. Using ultrafast infrared pump–probe …