Search results for "Circular dichroism spectra"

showing 3 items of 3 documents

Interactions of benzodiazepines with human serum albumin. Circular dichroism studies.

1973

The circular dichroism spectra of 12 benzodiazepine derivatives studied in presence of human serum albumin are presented. Nearly all substances give biphasic extrinsic Cotton effects. At the CD maxima the molar ellipticities and the anisotropy factors are calculated. The influence of the chemical structure of the benzodiazepines on the induced Cotton effect is discussed. There is a linear correlation between the anisotropy factors and the logarithms of the partition coefficients of the substances. It is suggested that the phenyl ring of the benzodiazepine molecule is one of the essential groups for the binding of these substances to human serum albumin.

PharmacologyBenzodiazepineCircular dichroismChromatographyBinding SitesChemistrymedicine.drug_classChemical structureCircular DichroismGeneral MedicineBenzazepinesHuman serum albuminCircular dichroism spectraPartition coefficientStructure-Activity RelationshipOptical Rotatory DispersionmedicineMoleculeHumansSpectrophotometry UltravioletChlorineCotton effectSerum Albuminmedicine.drugProtein BindingNaunyn-Schmiedeberg's archives of pharmacology
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Triggering dissymmetry in achiral dye molecules by chiral solvents: Circular dichroism experiments and DFT calculations

2011

The electronic circular dichroism spectra of achiral product “Lumogen F Red” (ROT-300) in four different chiral solvents are recorded at different temperatures. DFT calculations allow to identify two enantiomeric conformers for ROT-300. In vacuo they are equally populated; in chiral solvents one enantiomer prevails. Thermodynamic quantities involved in the chiral preference are derived. Chirality, 2011. © 2011 Wiley-Liss, Inc.

Models MolecularCircular dichroismMolecular ConformationPhotochemistryCatalysisAnalytical ChemistryProchiralityComputational chemistryDrug Discoverycircular dichroism (CD)time-dependent density functional theory (TDDFT)MoleculeColoring AgentsConformational isomerismSpectroscopySettore CHIM/02 - Chimica FisicaPharmacologyChemistryCircular DichroismOrganic ChemistryStereoisomerismCircular dichroism spectradye molecules solvent effectSolventsQuantum TheoryEnantiomerChirality (chemistry)Chirality
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Dynamic Structural Changes and Thermodynamics in Phase Separation Processes of an Intrinsically Disordered–Ordered Protein Model

2021

Elastin-like proteins (ELPs) are biologically important proteins and models for intrinsically disordered proteins (IDPs) and dynamic structural transitions associated with coacervates and liquid-liquid phase transitions. However, the conformational status below and above coacervation temperature and its role in the phase separation process is still elusive. Employing matrix least-squares global Boltzmann-fitting of the circular dichroism spectra of the ELPs (VPGVG) 20 , (VPGVG) 40 and (VPGVG) 60 , we found that coacervation occurs sharply when a certain number of repeat units has acquired β-turn conformation (in our sequence setting a threshold of ~20 repeat units). The differential scatter…

Models Molecular540 Chemistry and allied sciencesPhase transitionCircular dichroismCoacervateProtein ConformationChemistryPhase separation processCircular DichroismSequence (biology)General ChemistryIntrinsically disordered proteinsCircular dichroism spectraCatalysisIntrinsically Disordered Proteins540 ChemieBiophysicsProtein modelHumansThermodynamicsPeptidesAngewandte Chemie International Edition
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