Search results for "X-Ray scattering"

showing 10 items of 165 documents

Structural model of gelation processes of a sodium silicate sol destabilized by calcium ions: combination of SAXS and rheological measurements

2005

This study deals with the physico-chemical processes involved in the formation of basic fractal silica gels derived from a sodium silicate sol destabilized by calcium ions. Using small-angle X-ray scattering and dynamic rheological measurements, structural and viscoelastic properties have been investigated in situ during aggregation and gelation processes. The experimental results lead to a consistent model that describes the structural features and aggregation mechanisms involved in the formation of these gels.

Materials scienceSmall-angle X-ray scatteringSilica gelSodiumchemistry.chemical_elementMineralogySodium silicateCalciumCondensed Matter PhysicsSilicateViscoelasticityElectronic Optical and Magnetic MaterialsCondensed Matter::Soft Condensed Matterchemistry.chemical_compoundchemistryChemical engineeringRheologyMaterials ChemistryCeramics and CompositesJournal of Non-Crystalline Solids
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Structure of anisole derivatives by total neutron and X-ray scattering: Evidences of weak C–H⋯O and C–H⋯π interactions in the liquid state

2020

Abstract High resolution, total neutron and X-ray scattering data have been used in synergy with Molecular Dynamics simulations to access atomistic scale insight into the structure of anisole and 2,3,5-trimethylanisole, two aromatic compounds bearing an electron-donating methoxy group. A detailed description is provided for the main interactions occurring in these systems, including π-π stacking and weak hydrogen bonding correlations: C H⋯O and C H⋯π. The existence of preferential orientations of the first shell coordinating molecules and the specific nature of the interactions involving the π cloud and the polar methoxy group have been reported and discussed.

Materials scienceStacking02 engineering and technologyNeutron scattering010402 general chemistry01 natural sciencesAnisole Hydrogen bonding Solvation π-πstocking Neutron scattering X-ray scattering Molecular dynamicchemistry.chemical_compoundMolecular dynamicsMaterials ChemistryMoleculePhysical and Theoretical ChemistrySpectroscopyScatteringHydrogen bondSolvation021001 nanoscience & nanotechnologyCondensed Matter PhysicsAnisoleAtomic and Molecular Physics and Optics0104 chemical sciencesElectronic Optical and Magnetic MaterialsCrystallographychemistryAnisole Aromatic C–H/O C–H/π Hydrogen bonding Molecular dynamics Neutron scattering Solvation X-ray scattering π-π stacking0210 nano-technology
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Supramolecular Packing Drives Morphological Transitions of Charged Surfactant Micelles

2020

Abstract The shape and size of self‐assembled structures upon local organization of their molecular building blocks are hard to predict in the presence of long‐range interactions. Combining small‐angle X‐ray/neutron scattering data, theoretical modelling, and computer simulations, sodium dodecyl sulfate (SDS), over a broad range of concentrations and ionic strengths, was investigated. Computer simulations indicate that micellar shape changes are associated with different binding of the counterions. By employing a toy model based on point charges on a surface, and comparing it to experiments and simulations, it is demonstrated that the observed morphological changes are caused by symmetry br…

Materials scienceSupramolecular chemistryIonic bondingNeutron scattering010402 general chemistryMicelle01 natural sciencesCatalysisdimersdetergentSymmetry breakingResearch Articleschemistry.chemical_classificationSmall-angle X-ray scattering010405 organic chemistrymolecular modelingGeneral ChemistryGeneral Medicineself-assemblydimer0104 chemical sciencesCondensed Matter::Soft Condensed MattermicelllechemistrydetergentsChemical physicsMicelllesSelf-assemblyCounterionResearch Article
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Low temperature synthesis of monodisperse nanoscaled ZrO2with a large specific surface area

2012

Thermal decomposition of Zr(C(2)O(4))(2)·4H(2)O within an autoclave or in a conventional tube furnace at temperatures below 380 °C resulted in nano- and micron-sized ZrO(2), respectively. Reactions under autogenic pressure yielded monodisperse monoclinic (m) and tetragonal (t) ZrO(2) nanoparticles with an average diameter of ~8 nm and interconnected t-ZrO(2) nanoparticles with diameters of ~4 nm, depending on the synthesis temperature. Samples were characterised by X-ray diffraction (XRD), small angle X-ray scattering (SAXS), scanning electron microscopy (SEM), transmission electron microscopy (TEM) associated with energy dispersive X-ray spectroscopy (EDS), Raman microspectroscopy and phot…

Materials scienceSurface PropertiesScanning electron microscopeSmall-angle X-ray scatteringSpectrum AnalysisThermal decompositionTemperatureNanoparticleNanotechnologyChemistry Techniques SyntheticNanostructuresInorganic ChemistryChemical engineeringTransmission electron microscopySpecific surface areaThermogravimetryZirconiumParticle sizeMonoclinic crystal systemDalton Trans.
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Scaling in colloidal crystallization

1994

The process of colloidal crystallization has already been separately investigated by light scattering mearurements of the crystalline order (Bragg peaks) and of long-ranged density fluctuations (small-angle scattering). We present the firstsimultaneous small- and large-angle light scattering experiment. Our measurements have been performed on hard-sphere colloids of different particle densities. We show results for the temporal evolution of crystallization and find two distinct regimes: homogeneous nucleation and diffusion- or reaction-limited growth at early times, followed by ripening of the Lifshitz-Slyozov or Lifshitz-Allen-Cahn type. To our preliminary experience, we can already state …

Materials sciencebusiness.industryScatteringNucleationGeneral Physics and AstronomyLight scatteringlaw.inventionOpticsChemical physicslawParticleBiological small-angle scatteringCrystallizationDiffusion (business)Wide-angle X-ray scatteringbusinessIl Nuovo Cimento D
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Probing in cell protein structural changes with time-resolved X-ray scattering

2012

International audience; Investigating protein structural changes inside the cell is a major goal in molecular biology. Here we show that time-resolved wide-angle X-ray scattering is a valuable tool for this purpose. Hemoglobin has been chosen as a model system and its tertiary and quaternary conformational changes following laser flash-photolysis have been tracked in intact red blood cells with nanosecond time resolution.

Model system010402 general chemistry01 natural scienceslaw.invention03 medical and health scienceslaw030304 developmental biology0303 health sciencesChemistryScatteringX-rayTime resolutionin cell studieGeneral ChemistryNanosecondX-ray scatteringCondensed Matter PhysicsLaserConformational changeSettore FIS/07 - Fisica Applicata(Beni Culturali Ambientali Biol.e Medicin)0104 chemical sciencesCrystallographyChemical physicsAllosteric transitionProtein dynamicsense organs[PHYS.COND.CM-SCM]Physics [physics]/Condensed Matter [cond-mat]/Soft Condensed Matter [cond-mat.soft]
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Structure of the Human TRPML2 Ion Channel Extracytosolic/Lumenal Domain.

2019

Summary TRPML2 is the least structurally characterized mammalian transient receptor potential mucolipin ion channel. The TRPML family hallmark is a large extracytosolic/lumenal domain (ELD) between transmembrane helices S1 and S2. We present crystal structures of the tetrameric human TRPML2 ELD at pH 6.5 (2.0 A) and 4.5 (2.95 A), corresponding to the pH values in recycling endosomes and lysosomes. Isothermal titration calorimetry shows Ca2+ binding to the highly acidic central pre-pore loop which is abrogated at low pH, in line with a pH-dependent channel regulation model. Small angle X-ray scattering confirms the ELD dimensions in solution. Changes in pH or Ca2+ concentration do not affect…

Models Molecular0303 health sciencesBinding SitesTRPMLEndosomeChemistrySmall-angle X-ray scatteringProtein Conformation030302 biochemistry & molecular biologyIsothermal titration calorimetryHydrogen-Ion ConcentrationCrystallography X-Ray03 medical and health sciencesTransient receptor potential channelTransmembrane domainTransient Receptor Potential ChannelsProtein DomainsStructural BiologyBiophysicsHumansCalciumMolecular BiologyProtein secondary structureIon channel030304 developmental biologyStructure (London, England : 1993)
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All hierarchical levels are involved in conformational transitions of the 4×6-meric tarantula hemocyanin upon oxygenation

2002

The respiratory protein of the tarantula Eurypelma californicum is a 4 x 6-meric hemocyanin that binds oxygen with high cooperativity. This requires the existence of different conformations which have been confirmed by small angle X-ray scattering (SAXS). Here we present reconstructed 3D-models of the oxy- and deoxy-forms of tarantula hemocyanins, as obtained by fitting small angle X-rays scattering curves on the basis of known X-ray structures and electron microscopy of related hemocyanins. For the first time, the involvement of movements at all levels of the quaternary structure was confirmed for an arthropod hemocyanin upon oxygenation. The two identical 2 x 6-meric half-molecules of the…

Models MolecularMacromolecular SubstancesProtein Conformationmedicine.medical_treatmentAllosteric regulationBiophysicsCooperativityRandom hexamerBiochemistryOligomerAnalytical Chemistrychemistry.chemical_compoundmedicineAnimalsMolecular BiologySmall-angle X-ray scatteringSpidersHemocyaninOxygenRespiratory proteinCrystallographychemistryHemocyaninsProtein quaternary structureOxidation-ReductionProtein BindingBiochimica et Biophysica Acta (BBA) - Proteins and Proteomics
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Organometallic Oligomers Based on Bis(arylacetylide)bis(P-chirogenic phosphine)platinum(II) Complexes: Synthesis and Photonic Properties

2013

A series of P-chirogenic oligomers of the type (-C≡C-aryl-C≡C-PtL2-)n [L = (R)- and (S)-P(Ph)(iPr)(C17H35); aryl = 1,4-benzene, 2,1,3-benzothiadiazole] along the corresponding achiral analogues (L = PBu3) and model complexes PhC≡CPtL2C≡CPh were prepared from the ephedrine strategy and were fully characterized [(1)H, (31)P NMR; IR; small-angle X-ray scattering (SAXS); gel permeation chromatography (GPC); thermal gravimetric analysis (TGA); circular dichroism, UV-vis, and luminescence spectroscopy; photophysics, and degree of anisotropy measurements]. From the CD measurements, the chiral environment of the phosphine ligands is modestly felt by the aryl moieties. Concurrently, the TGA shows th…

Models MolecularPhotonsCircular dichroismThermogravimetric analysisMolecular StructureOrganoplatinum CompoundsAcetylenePhosphinesSmall-angle X-ray scatteringChemistryLigandArylMolecular Dynamics SimulationPhotochemistryInorganic ChemistryGel permeation chromatographychemistry.chemical_compoundPolymer chemistryPhysical and Theoretical ChemistryLuminescencePhosphineInorganic Chemistry
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The Monod-Wyman-Changeux allosteric model accounts for the quaternary transition dynamics in wild type and a recombinant mutant human hemoglobin

2012

International audience; The acknowledged success of the Monod-Wyman-Changeux (MWC) allosteric model stems from its efficacy in accounting for the functional behavior of many complex proteins starting with hemoglobin (the paradigmatic case) and extending to channels and receptors. The kinetic aspects of the allosteric model, however, have been often neglected, with the exception of hemoglobin and a few other proteins where conformational relaxations can be triggered by a short and intense laser pulse, and monitored by time-resolved optical spectroscopy. Only recently the application of time-resolved wide-angle X-ray scattering (TR-WAXS), a direct structurally sensitive technique, unveiled th…

Models MolecularProtein ConformationcooperativityMESH: Catalytic DomainCooperativity01 natural sciencesMESH: Recombinant ProteinsHemoglobinsProtein structureMESH: Protein ConformationCatalytic Domainprotein structural dynamicsMESH: Allosteric Site0303 health sciencesMultidisciplinaryallosterybiologyMESH: KineticsChemistryBiological SciencesRecombinant Proteins[SDV.BBM.BP]Life Sciences [q-bio]/Biochemistry Molecular Biology/BiophysicsMESH: HemoglobinsAllosteric SiteMESH: Models MolecularAdultMESH: MutationStereochemistryKineticsAllosteric regulation010402 general chemistry03 medical and health sciencesprotein conformational changesflash photolysisallostery; cooperativity; flash photolysis; hemoglobin; protein conformational changes; protein structural dynamics; time-resolved wide angle x ray scattering; time-resolved x-ray scatteringHumans030304 developmental biologytime-resolved X-ray scattering; protein conformational changes; cooperativity; flash photolysisMESH: Humanstime-resolved X-ray scatteringWild typeActive sitetime-resolved wide angle x ray scatteringMESH: AdulthemoglobinSettore FIS/07 - Fisica Applicata(Beni Culturali Ambientali Biol.e Medicin)0104 chemical sciencesprotein conformational changeKineticsAllosteric enzymeMutationbiology.proteinHemoglobin
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