排序方式: 共有20条查询结果,搜索用时 31 毫秒
1.
Jagoda M Warzeska S Pritzkow H Wadepohl H Imhof P Smith JC Krämer R 《Journal of the American Chemical Society》2005,127(43):15061-15070
For a number of phosphoryltransfer enzymes, including the exonuclease subunit of DNA polymerase I, a mechanism involving two-metal ions and double Lewis-acid activation of the substrate, combined with leaving group stabilization, has been proposed. Inspired by the active site structure of this enzyme, we have designed as a synthetic phosphoryl transfer catalyst the dicopper(II) macrocyclic complex LCu(2). Crystal structures of complexes [(L)Cu(2)(mu-NO(3))(NO(3))](NO(3))(2) (1), [(L)Cu(2)(mu-CO(3))(CH(3)OH)](BF(4))(2) (2), and [(L)Cu(2)(mu-O(2)P(OCH(3))(2))(NO(3))](NO(3))(2) (3) illustrate various possibilities for the interaction of oxoanions with the dicopper(II) site. 1 efficiently promotes the transesterification of dimethyl phosphate (DMP) in CD(3)OD, k(cat) = 2 x 10(-)(4) s(-)(1) at 55 degrees C. 1 is the only available catalyst for the smooth transesterification of highly inert simple dialkyl phosphates. From photometric titrations and the pH dependence of reactivity, we conclude that a complex [(L)Cu(2)(DMP)(OCH(3))](2+) is the reactive species. Steric bulk at the -OR substituents of phosphodiester substrates O(2)P(OR)(2)(-) drastically reduces the reactivity of 1. This is explained with -OR leaving group stabilization by Cu coordination, an interaction which is sensitive to steric crowding at the alpha-C-atom of substituent R. A proposed reaction mechanism related to that of the exonuclease unit of DNA polymerase I is supported by DFT calculations on reaction intermediates. The complex [(L)Cu(3)(mu(3)-OH)(mu-CH(3)O)(2)(CH(3)CN)(2)](ClO(4))(3) (4) incorporates a [Cu(OH)(OCH(3))(2)(CH(3)CN)(2)](-) complex anion, which might be considered as an analogue of the [PO(2)(OCH(3))(2)(OCD(3))](2)(-) transition state (or intermediate) of DMP transesterification catalyzed by LCu(2). 相似文献
2.
Marija argonja Darko Mekterovi Paula
urga Jagoda Ravli‐Gulan Iva Bogdanovi Radovi Gordana
auhar 《X射线光谱测定》2021,50(1):68-79
During metal welding and cutting, large amounts of particulate matter (PM) are produced that might represent a significant health risk for the exposed workers. In the present pilot study, we performed an elemental analysis of fine PM collected in a metal workshop. Also, elemental analysis of the hair and nail samples collected from workers exposed to the workshop dust and control group was done. Concentrations of 15 elements in PM were measured with X‐Ray Fluorescence (XRF) and Particle Induced X‐ray Emission (PIXE), whereas inductively coupled plasma mass spectrometry (ICP‐MS) was used to determine 12 elements in hair and nail samples. Mean 8‐hr concentrations of PM2.5, Fe, and Mn in the vicinity of welders were up to 1803, 860, and 30 μg/m3, respectively, whereas in the nearby city, daily PM2.5 concentrations are on average 11 μg/m3. We found that several elements, especially Fe and Mn, had substantially higher concentrations in hair and nail samples of exposed workers than in the control group, which indicates the accumulation of metals in workers' tissues, although limit values were not exceeded. 相似文献
3.
The COVID-19 pandemic has raised many questions on how to manage an epidemiological and economic crisis around the world. Since the beginning of the COVID-19 pandemic, scientists and policy makers have been asking how effective lockdowns are in preventing and controlling the spread of the virus. In the absence of vaccines, the regulators lacked any plausible alternatives. Nevertheless, after the introduction of vaccinations, to what extent the conclusions of these analyses are still valid should be considered. In this paper, we present a study on the effect of vaccinations within the dynamic stochastic general equilibrium model with an agent-based epidemic component. Thus, we validated the results regarding the need to use lockdowns as an efficient tool for preventing and controlling epidemics that were obtained in November 2020. 相似文献
4.
R. Cramer M. Renkhoff J. Drees U. Ecker D. Jagoda K. Koseck G. -R. Pingel B. Remenschnitter A. Ritterskamp B. Boden V. Burkert G. Knop M. Leenen R. Sauerwein D. Schablitzky 《Zeitschrift fur Physik C Particles and Fields》1985,29(4):513-518
Elastic electron deuteron scattering was measured at the Bonn 2.5 GeV Electron-Synchrotron using a two spectrometer coincidence technique. Data were taken at values of the four momentum transfer squaredQ 2=0.50, 0.60, 0.78, 1.00, and 1.3 (GeV/c)2 at electron scattering angles θ e =77.5° to 139.0° in order to separate the magnetic dipole formfactorF M (Q 2) from the electric formfactorF E (Q 2). Experimental cross sections are compared to theoretical predictions and to measurements of other laboratories. The results indicate that contributions from meson exchange currents are not negligible in thisQ 2 region. 相似文献
5.
Jagoda Kuc Yucheng Zhang Rolf Erni Songhak Yoon Lassi Karvonen Anke Weidenkaff Santhosh Kumar Matam 《固体物理学:研究快报》2015,9(5):282-287
The self‐regenerative property of LaCo1–x –yPdx Zny O3±δ and LaFe1–x –yPdx Zny O3±δ solid solutions with monometallic Pd or bimetallic Pd/Zn substituents for Co or Fe is studied under a redox cycle by high angular annular dark‐field scanning transmission electron microscopy (STEM‐HAADF) and energy dispersive X‐ray spectroscopy (EDX) and X‐ray diffraction (XRD). These results reveal that the composition of perovskites determines the self‐regenerative property that occurs largely in LaCo1–x –yPdx Zny O3±δ but is limited greatly in LaFe1–x –yPdx Zny O3±δ. (© 2015 WILEY‐VCH Verlag GmbH &Co. KGaA, Weinheim) 相似文献
6.
Jagoda A Ketikidis P Zinn M Meier W Kita-Tokarczyk K 《Langmuir : the ACS journal of surfaces and colloids》2011,27(17):10878-10885
Polyhydroxyalkanoates (PHAs) are biodegradable, biocompatible polyesters and very attractive candidates for biomedical applications as materials for tissue engineering. They have a hydrophobic character, but some are able to spread at the air-water interface to form monomolecularly thin films (Langmuir monolayers). This is a very convenient model to analyze PHA self-assembly in two dimensions and to study their molecular interactions with other amphiphilic compounds, which is very important considering compatibility between biomaterials and cell membranes. We used the Langmuir monolayer technique and Brewster angle microscopy to study the properties of poly([R]-3-hydroxy-10-undecenoate) (PHUE) films on the free water surface in various experimental conditions. Moreover, we investigated the interactions between the polymer and one of the main biomembrane components, 1,2-dioleoyl-sn-glycero-3-phosphocholine (DOPC). The addition of lipid to a polymer film does not change the monolayer phase behavior; however, the interactions between these two materials are repulsive and fall in two composition-dependent regimes. In summary, this is the first systematic study of the monolayer behavior of PHUE, thus forming a solid basis for a thorough understanding of material interactions, in particular in the context of biomaterials and implants. 相似文献
7.
Lidia Jagoda Opuchlik Michal Kizling Pawel Bacal Renata Bilewicz 《Electroanalysis》2019,31(10):2048-2056
Glassy carbon electrode (GCE) coated with anisotropic gold nanoplates (aAuNPs) was used for the study of oxygen reduction reaction (ORR) in 0.5 M sulfuric acid instead of bulk gold electrodes. The electrode cleaning/activation procedure lead to the removal of any charged and uncharged residues on the gold nanoplates, leaving the nanostructured surface highly active towards oxygen reduction. The advantages: much lower overpotential and larger current densities of oxygen reduction are ascribed to the unique nanostructures present on the carbon electrode surface‐the gold nanoplates. They are rich in edges providing a large population of Au (100) sites with unsaturated coordination exposed to the solution, and catalytically active. Measurements performed using a rotating disc electrode, modified with the gold nanoplates, confirmed that ORR proceeds via two separate steps: oxygen is reduced to hydrogen peroxide, and the peroxide is further reduced in a two‐electron reduction to water. 相似文献
8.
Barbara Jagoda‐Cwiklik Dr. Pavel Jungwirth Prof. Lubomír Rulíšek Dr. Petr Milko Jana Roithová Dr. Joël Lemaire Dr. Philippe Maitre Dr. Jean Michel Ortega Dr. Detlef Schröder Dr. 《Chemphyschem》2007,8(11):1629-1639
Coordination complexes of the magnesium nitrate cation with water [MgNO(3)(H(2)O)(n)](+) up to n=7 are investigated by experiment and theory. The fragmentation patterns of [MgNO(3)(H(2)O)(n)](+) clusters generated via electrospray ionization indicate a considerable change in stability between n=3 and 4. Further, ion-molecule reactions of mass-selected [MgNO(3)(H(2)O)(n)](+) cations with D(2)O reveal the occurrence of consecutive replacement of water ligands by heavy water, and in this respect the complexes with n=4 and 5 are somewhat more reactive than their smaller homologs with n=1-3 as well as the larger clusters with n=6 and 7. For the latter two ions, the theory suggests the existence of isomers, such as complexes with monodentate nitrato ligands as well as solvent-separated ion pairs with a common solvation shell. The reactions observed and the ion thermochemistry are discussed in the context of ab initio calculations, which also reveal the structures of the various hydrated cation complexes. 相似文献
9.
Sonja Kozar Anamaria Bujak Jagoda Eder-Trifunovi Goran Kniewald 《Fresenius' Journal of Analytical Chemistry》1988,329(7):760-763
Summary Concentrations ofl-ascorbic acid in fresh and processed fruit and vegetables were determined by differential pulse polarography (DPP).This method has been found to be convenient for the determination ofl-ascorbic acid in all investigated vegetables, as well as in citrus fruits, strawberries, raspberries and currants. The method cannot be recommended forl-ascorbic acid determination in cherries, sour cherries and bananas due to an inhibition of the electrode reaction or to the nature of vitamin C decomposition pathways in certain fruits.
Bestimmung vonl-Ascorbinsäure in frischem und verarbeitetem Obst und Gemüse durch Differential-Puls Polarographie相似文献
10.
Jagoda Drozdzak Martine Leermakers Yue Gao Vannapha Phrommavanh Michael Descostes 《Analytica chimica acta》2015
A new resin- Diphonix® in Diffusive Gradients in Thin Films (DGT) technique for the determination of uranium was investigated and compared with previously used binding phases for uranium, Chelex®-100 and Metsorb™. The DGT gel preparation and the elution procedure were optimized for the new resin. The U uptake on Diphonix® resin gel was 97.4 ± 1.5% (batch method; [U] = 20 μg L−1; 0.01 M NaNO3; pH = 7.0 ± 0.2). The optimal eluent was found to be 1 M 1-hydroxyethane-1, 1-diphosphonic acid (HEDPA) with an elution efficiency of 80 ± 4.2%. Laboratory DGT study on U accumulation using a DGT samplers with Diphonix® resin showed a very good performance across a wide range of pH (3–9) and ionic strength (0.001–0.7 M NaNO3). Diffusion coefficients of uranium at different pH were determined using both, a diffusion cell and the DGT time-series, demonstrating the necessity of the implementation of the effective diffusion coefficients into U-DGT calculations. Diphonix® resin gel exhibits greater U capacity than Chelex®-100 and Metsorb™ binding phase gels (a Diphonix® gel disc is not saturated, even with loading of 10.5 μmol U). Possible interferences with Ca2+ (up to 1.33 × 10−2 M), PO43− (up to 1.72 × 10−4 M), SO42− (up to 4.44 × 10−3 M) and −HCO3 (up to 8.20 × 10−3 M) on U-DGT uptake ([U] = 20 μg L−1) were investigated. No effect or minor effect of Ca2+, PO43−, SO42−, and −HCO3 on the quantitative measurement of U by Diphonix®-DGT was observed. The results of this study demonstrated the DGT technique with Diphonix® resin is a reliable and robust method for the measurement of labile uranium species under laboratory conditions. 相似文献