Search results for "circular"

showing 10 items of 856 documents

Studies on Adduct Formation of (+)-Anti-Benzo[a]pyrene 7,8-Dihydrodiol 9,10-Epoxide with the oligonucleotides 5′-d(CCTATCGTTATCC) and 5′-d(CCTATm5CGT…

1999

Abstract Adduct formation of (+)-anti-benzo[a]pyrene 7,8-dihydrodiol 9,10-epoxide [BPDE] and 5′-d(CCTATCGTTATCC) or 5′-d(CCTATm5CGTTATCC) (G = binding target) has been studied. The extent of trans-BPDE-N2-dG adduct formation was higher in the oligonucleotide with 5′-d(m5CG) sequence context in both single- and double stranded form compared to the non-methylated analogue. The stimulating effect of m5dC on adduct formation has previously been demonstrated in other experimental systems. The increase in yield could possibly be rationalized in terms of prestacking of the pyrenyl ring with the nucleobases prior to the nucleophilic addition. In the present study, both UV absorption and induced cir…

Circular dichroismNucleophilic additionPolymers and PlasticsOligonucleotideStereochemistryOrganic ChemistryEpoxideNucleobaseAdductchemistry.chemical_compoundBenzo(a)pyrenechemistrypolycyclic compoundsMaterials ChemistryPyrenePolycyclic Aromatic Compounds
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Separation, isolation and stereochemical assignment of imazalil enantiomers and their quantitation in an in vitro toxicity test

2016

A simple method for the separation of the enantiomers of the fungicide imazalil was developed. Racemic imazalil was separated into its enantiomers with an enantiomeric purity of 99% using HPLC-UV with an enantioselective column (permethylated cyclodextrin) operated in reversed phase mode (water with 0.2% trimethylamine and 0.08% acetic acid and methanol). The absolute configuration of the separated enantiomers was assigned and unequivocally confirmed by optical rotation as well as by vibrational circular dichroism (VCD) and electronic circular dichroism (ECD) combined with ab-initio calculations. The same enantioselective column was also used to develop an HPLC-MS/MS method for the quantifi…

Circular dichroismOptical RotationTrimethylamineIn Vitro Techniques010501 environmental sciencesTandem mass spectrometryVibration01 natural sciencesBiochemistryAnalytical Chemistrychemistry.chemical_compoundTandem Mass SpectrometryToxicity TestsImazalil Enantiomers HPLC-UV Isolation Vibrational circular dichroism HPLC–MS/MSHumansChromatography High Pressure Liquid0105 earth and related environmental scienceschemistry.chemical_classificationChromatographyCyclodextrin010405 organic chemistryCircular DichroismOrganic ChemistryImidazolesAbsolute configurationEnantioselective synthesisStereoisomerismGeneral MedicineFungicides Industrial0104 chemical scienceschemistryVibrational circular dichroismSteroidsEnantiomerJournal of Chromatography A
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Titration of poly(dA-dT) · poly(dA-dT) in solution at variable NaCl concentration

2004

CD and uv absorption data showed that high molecular weight poly(dA-dT) . poly(dA-dT), at 298 K, undergoes an acid-induced transition from B-double helix to random coil in NaCl solutions of different concentrations, ranging from 0.005 to 0.600M. Similarly, titration of the polynucleotide with a strong base causes duplex-to-single strands transition. The base- and acid-induced transitions were both reversible by back-titration (with an acid or, respectively, with a base): the apparent pKa were the same in both directions. However, the number of protons per titratable site (adenine N1) required to reach half-denaturation was in great excess over the stoichiometric value; to a much larger exte…

Circular dichroismOrganic ChemistryBiophysicsGeneral MedicineBiochemistryPolyelectrolyteRandom coilThymineBiomaterialsCrystallographychemistry.chemical_compoundDeprotonationchemistryPolynucleotideCounterion condensationOrganic chemistryTitrationBiopolymers
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Characterization of the interaction between Actinin-Associated LIM Protein (ALP) and the rod domain of α-actinin

2009

Abstract Background The PDZ-LIM proteins are a family of signalling adaptors that interact with the actin cross-linking protein, α-actinin, via their PDZ domains or via internal regions between the PDZ and LIM domains. Three of the PDZ-LIM proteins have a conserved 26-residue ZM motif in the internal region, but the structure of the internal region is unknown. Results In this study, using circular dichroism and nuclear magnetic resonance (NMR), we showed that the ALP internal region (residues 107–273) was largely unfolded in solution, but was able to interact with the α-actinin rod domain in vitro, and to co-localize with α-actinin on stress fibres in vivo. NMR analysis revealed that the ti…

Circular dichroismPDZ domaineducationAmino Acid MotifsMolecular Sequence DataPlasma protein bindingActininmacromolecular substancesBiology03 medical and health sciences0302 clinical medicineCell Line TumorHumansActininAmino Acid Sequencelcsh:QH573-671Peptide sequenceActin030304 developmental biologyLIM domainFluorescent Dyes0303 health scienceslcsh:CytologyMicrofilament ProteinsCell BiologyLIM Domain ProteinsSurface Plasmon Resonancemusculoskeletal systemRecombinant ProteinsCell biologyProtein Structure TertiaryLHX3Peptides030217 neurology & neurosurgeryResearch ArticleProtein BindingBMC Cell Biology
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Chiral self-sorting behaviour of [2.2]paracyclophane-based bis(pyridine) ligands

2019

Two constitutionally isomeric chiral bis(pyridine) ligands based on planar chiral 4,15-difunctionalized [2.2]paracyclophanes were synthesized, the respective enantiomers were separated via HPLC on a chiral stationary phase, and their self-assembly behaviour upon coordination to palladium(ii) ions was studied with regard to chiral self-sorting effects. As proven by NMR spectroscopy, mass spectrometry, CD spectroscopy, UV-Vis spectroscopy and X-ray crystallography both ligands form the expected dinuclear complexes upon coordination to cis-protected di- or tetravalent palladium(ii) ions, respectively, however, with distinct differences concerning their chiral self-sorting ability. peerReviewed

Circular dichroismPalladium compoundsmassaspektrometriaPyridinechemistry.chemical_element010402 general chemistryMass spectrometryLigands01 natural sciencesIonchemistry.chemical_compoundPyridineNMR-spektroskopiaSpectroscopyta116Nuclear magnetic resonance spectroscopyUltraviolet visible spectroscopyMass spectrometry010405 organic chemistryligandsCircular dichroism spectroscopyNuclear magnetic resonance spectroscopyX ray crystallographyliganditkidetiede0104 chemical sciencesorganic chemistryCrystallographychemistrySynthesis (chemical)orgaaninen kemiaEnantiomerPalladiumOrganic Chemistry Frontiers
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The dependence of circular dichroism in photoemission on the optical properties of Cs monolayers on Pt(111)

1997

We report on the dependence of dichroic photoemission excited by circularly polarised light on the angle of photon incidence. We measured the difference in the angle-resolved photoemission intensities from Cs 5p semi-core levels excited by photons of opposite helicity, which is known as CDAD. We found that the dependence of the measured differences on the angle of light incidence deviates strongly from the model of CDAD for free atoms, as expected. Using the Fresnel equations and a complex index of refraction, one finds that not only the third component but also the second component of the Stokes vector is responsible for the excitation process. Both Stokes components change sign if the ini…

Circular dichroismPhotonChemistryAnalytical chemistryPhysics::OpticsSurfaces and InterfacesFresnel equationsCondensed Matter PhysicsLinear dichroismHelicitySurfaces Coatings and Filmssymbols.namesakeExcited stateMaterials ChemistrysymbolsStokes parametersAtomic physicsRefractive indexSurface Science
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Novel atrazine-binding biomimetics inspired to the D1 protein from the photosystem II of Chlamydomonas reinhardtii.

2020

Biomimetic design represents an emerging field for improving knowledge of natural molecules, as well as to project novel artificial tools with specific functions for biosensing. Effective strategies have been exploited to design artificial bioreceptors, taking inspiration from complex supramolecular assemblies. Among them, size-minimization strategy sounds promising to provide bioreceptors with tuned sensitivity, stability, and selectivity, through the ad hoc manipulation of chemical species at the molecular scale. Herein, a novel biomimetic peptide enabling herbicide binding was designed bioinspired to the D1 protein of the Photosystem II of the green alga Chlamydomonas reinhardtii. The D1…

Circular dichroismPhotosystem IIProtein ConformationSupramolecular chemistryPlastoquinoneChlamydomonas reinhardtiiPeptide02 engineering and technologyMolecular Dynamics SimulationBiochemistryFluorescence spectroscopy03 medical and health scienceschemistry.chemical_compoundStructural BiologyBiomimeticsAmino Acid SequencePhotosynthesisMolecular Biology030304 developmental biologychemistry.chemical_classification0303 health sciencesbiologyRational designphotosystem IIPhotosystem II Protein ComplexGeneral Medicine021001 nanoscience & nanotechnologybiology.organism_classificationSpectrometry FluorescencechemistryArtificial peptides Atrazine sensing Rational designBiophysicsThermodynamicsAtrazine0210 nano-technologyPeptidesChlamydomonas reinhardtiiInternational journal of biological macromolecules
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Supramolecular Chirogenesis in Bis-Porphyrin: Crystallographic Structure and CD Spectra for a Complex with a Chiral Guanidine Derivative

2021

The complexation of (3aR,7aR)-N-(3,5-bis(trifluoromethyl)phenyl)octahydro-2H-benzo[d]imidazol-2-imine (BTI), as a guest, to ethane-bridged bis(zinc octaethylporphyrin), bis(ZnOEP), as a host, has been studied by means of ultraviolet-visible (UV-Vis) and circular dichroism (CD) absorption spectroscopies, single crystal X-ray diffraction, and computational simulation. The formation of 1:2 host-guest complex was established by X-ray diffraction and UV-Vis titration studies. Two guest BTI molecules are located at the opposite sides of two porphyrin subunits of bis(ZnOEP) host, which is resting in the anti-conformation. The complexation of BTI molecules proceed via coordination of the imine nitr…

Circular dichroismPhysics and Astronomy (miscellaneous)General MathematicsImineSupramolecular chemistrychiralityCrystal structurehost-guest binding010402 general chemistryguanidine01 natural sciencesDFTsupramolecular chemistrykemialliset sidoksetchemistry.chemical_compoundsupramolekulaarinen kemiaComputer Science (miscellaneous)Molecule[CHIM]Chemical SciencesGuanidine010405 organic chemistrylcsh:Mathematicstiheysfunktionaaliteoriahost–guest bindinglcsh:QA1-939Porphyrin0104 chemical sciencescircular dichroismCrystallographyTD-DFT simulationchemistryChemistry (miscellaneous)Chirality (chemistry)porphyrin
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Circular dichroism of polynucleotides: Interactions of NiCl2 with poly(dA-dT).poly(dA-dT) and poly(dG-dC).poly(dG-dC) in a water-in-oil microemulsion.

2008

The thermal behavior of the synthetic, high molecular weight, double stranded polynucleotides poly(dA-dT)·poly(dA-dT) [polyAT] and poly(dG-dC)·poly(dG-dC) [polyGC] solubilized in the aqueous core of the quaternary water-in-oil cationic microemulsion CTAB|n-pentanol|n-hexane|water in the presence of increasing amounts of NiCl2 at several constant ionic strength values (NaCl) has been studied by means of circular dichroism and electronic absorption spectroscopies. In the microemulsive medium, both polynucleotides show temperature-induced modifications that markedly vary with both Ni(II) concentration and ionic strength. An increase of temperature causes denaturation of the polyAT duplex at lo…

Circular dichroismPolynucleotidesAnalytical chemistryIonic bondingchemistry.chemical_elementmodel polynucleotideCatalysisAnalytical ChemistryNickelthermal denaturationDrug DiscoveryMicroemulsionSpectroscopyPharmacologyAqueous solutionChemistryCircular DichroismOrganic ChemistryCationic polymerizationTemperatureWaterCD and UV spectroscopiesnickel (II) ionNickelCrystallographywater-in-oil microemulsionPolynucleotideIonic strengthEmulsionsOilsChirality
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A semi-empirical approach for the simulation of circular dichroism spectra of gramicidin A in a model membrane

1992

In an extension of our previous work (Bañó, M. C., Braco, L., and Abad, C. 1991. Biochemistry. 30:886-94), the kinetics of dissociation of gramicidin A double-stranded dimers into beta 6.3-helical monomers in small unilamellar vesicles prepared following different protocols, were investigated using in combination circular dichroism (CD) and high-performance liquid chromatography (HPLC). The analysis of the data from both techniques according to a two-component model strongly supports that any given CD pattern of gramicidin incorporated in the phospholipid bilayer can be deconvoluted essentially as a linear combination of the reference subspectra calculated for the double-stranded dimer and …

Circular dichroismProtein ConformationChemistryCircular DichroismDimerLipid BilayersGramicidinSynthetic membraneBiophysicsMembranes ArtificialBiophysical PhenomenaDissociation (chemistry)KineticsCrystallographychemistry.chemical_compoundMembraneMonomerModels ChemicalGramicidinLipid bilayerResearch ArticleBiophysical Journal
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