What can be learned from nuclear resonance vibrational spectroscopy: Vibrational dynamics and hemes
Nuclear resonance vibrational spectroscopy (NRVS; also known as nuclear inelastic
scattering, NIS) is a synchrotron-based method that reveals the full spectrum of vibrational …
scattering, NIS) is a synchrotron-based method that reveals the full spectrum of vibrational …
Recent advances in biosynthetic modeling of nitric oxide reductases and insights gained from nuclear resonance vibrational and other spectroscopic studies
This Forum Article focuses on recent advances in structural and spectroscopic studies of
biosynthetic models of nitric oxide reductases (NORs). NORs are complex metalloenzymes …
biosynthetic models of nitric oxide reductases (NORs). NORs are complex metalloenzymes …
Long-range modulations of electric fields in proteins
H Biava, T Schreiber, S Katz, JS Völler… - The Journal of …, 2018 - ACS Publications
Electrostatic interactions are essential for controlling the protein structure and function.
Whereas so far experimental and theoretical efforts focused on the effect of local …
Whereas so far experimental and theoretical efforts focused on the effect of local …
[PDF][PDF] SciPhon: a data analysis software for nuclear resonant inelastic X-ray scattering with applications to Fe, Kr, Sn, Eu and Dy
The synchrotron radiation technique of nuclear resonant inelastic X-ray scattering (NRIXS),
also known as nuclear resonance vibrational spectroscopy or nuclear inelastic scattering …
also known as nuclear resonance vibrational spectroscopy or nuclear inelastic scattering …
Evidence of protein collective motions on the picosecond timescale
We investigate the presence of structural collective motions on a picosecond timescale for
the heme protein, cytochrome c, as a function of oxidation and hydration, using terahertz …
the heme protein, cytochrome c, as a function of oxidation and hydration, using terahertz …
Moments in nuclear resonant inelastic x-ray scattering and their applications
Sum rules of the moments of the nuclear resonant inelastic x-ray scattering (NRIXS)
spectrum provide means of data analysis and information on atomic dynamics. We extend …
spectrum provide means of data analysis and information on atomic dynamics. We extend …
Experimental studies and computational modeling on cytochrome c reduction by quercetin: The role of oxidability and binding affinity
Quercetin is a potent reducing agent of cytochrome C (Cyt c). Cyt c plays a fundamental role
in the intrinsic apoptotic pathway, and there is evidence of the quercetin's role in this cellular …
in the intrinsic apoptotic pathway, and there is evidence of the quercetin's role in this cellular …
Revised CHARMM force field parameters for iron‐containing cofactors of photosystem II
S Adam, M Knapp‐Mohammady, J Yi… - Journal of …, 2018 - Wiley Online Library
Photosystem II is a complex protein–cofactor machinery that splits water molecules into
molecular oxygen, protons, and electrons. All‐atom molecular dynamics simulations have …
molecular oxygen, protons, and electrons. All‐atom molecular dynamics simulations have …
Unveiling the structure of a novel artificial heme‐enzyme with peroxidase‐like activity: A theoretical investigation
Abstract Fe (III)‐Mimochrome VI (MC6) is a recently reported artificial heme‐peptide
conjugate system with a high peroxidase‐like activity. By design, its structure features a five …
conjugate system with a high peroxidase‐like activity. By design, its structure features a five …
Three-dimensional structural model of chicken liver sulfite oxidase in its activated form
T Utesch, MA Mroginski - The Journal of Physical Chemistry …, 2010 - ACS Publications
Sulfite oxidase (SO) catalyzes the conversion of sulfite to sulfate in almost all living
organisms. In vertebrates, the catalytic process involves a rapid intramolecular electron …
organisms. In vertebrates, the catalytic process involves a rapid intramolecular electron …