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91.
Morin B Bourhis JM Belle V Woudstra M Carrière F Guigliarelli B Fournel A Longhi S 《The journal of physical chemistry. B》2006,110(41):20596-20608
We used site-directed spin-labeling electron paramagnetic resonance (EPR) spectroscopy to study the induced folding of the intrinsically disordered C-terminal domain of measles virus nucleoprotein (N(TAIL)). Four single-site N(TAIL) mutants (S407C, S488C, L496C, and V517C), located in three conserved regions, were prepared and labeled with a nitroxide paramagnetic probe. We could monitor the gain of rigidity that N(TAIL) undergoes in the presence of either the secondary structure stabilizer 2,2,2-trifluoroethanol (TFE) or one of its physiological partners, namely, the C-terminal domain (XD) of the viral phosphoprotein. The mobility of the spin label grafted at positions 488, 496, and 517 was significantly reduced upon addition of XD, contrary to that of the spin label bound to position 407, which was unaffected. Furthermore, the EPR spectra of spin-labeled S488C and L496C bound to XD in the presence of 30% sucrose are indicative of the formation of an alpha-helix in the proximity of the spin labels. Such an alpha-helix had been already identified by previous biochemical and structural studies. Using TFE we unveiled a previously undetected structural propensity within the N-terminal region of N(TAIL) and showed that its C-terminal region "resists" gaining structure even at high TFE concentrations. Finally, we for the first time showed the reversibility of the induced folding process that N(TAIL) undergoes in the presence of XD. These results highlight the suitability of site-directed spin-labeling EPR spectroscopy to identify protein regions involved in binding and folding events, while providing insights at the residue level. 相似文献
92.
Elie Younang Jean-Marie Andr Joseph Delhalle 《International journal of quantum chemistry》1992,41(2):257-271
In the framework of our study of the changes of the electric polarizability upon substituting heteroatomic linkages in conjugated hydrocarbon backbones, we have been led to examine the relative stability of eight compounds isoelectronic to the all-trans octatetraene using the Cox and Pilcher concept of stabilization energy (SE ), SE = ΔHa – ΣNABEAB, where ΔHa is the heat of atomization of the species under consideration and the EAB's are bond-energy terms. Full geometry optimizations at the 4-31G level have been performed to obtain the equilibrium geometries needed to deduce reliable semiempirical heats of formation from appropriate isodesmic processes. Some of the compounds containing the ? CH?N? and ? N?N ? groups have electric polarizabilities and stabilization energies comparable to octatetrene. 相似文献
93.
Batrice Alpha Elke Anklam Robert Deschenaux Jean-Marie Lehn Marek Pietraskiewiez 《Helvetica chimica acta》1988,71(5):1042-1052
Sythetic procedures have been deweloped for the preparation of sodium and lithium cryptates of the macrabicyclic ligands 1–11 containing pyridine, bipyridine, and biisoquinoline groups. They involve stepwise construction of the bicyclic system as will as direct macrobicyclisation procedures (Scheme 1) and give access to both symmetrical and dissymmetrical structures. Marked cation template effects have been found that facilitate the cyclisation processes. The ligands 1–11 were isolated as their cryptates with Na+ or Li+ cations. 相似文献
94.
Jamila Ghamri Herv Baussart Michel le Bras Jean-Marie Leroy 《Journal of Physics and Chemistry of Solids》1989,50(12):1237-1244
The mixed oxides BixEu1−xVO4 and BiyGd1−yVO4 crystallize in a zircon-type structure, for 0 <x < 0.6 and 0 < y < 0.64, and in a fergusonite-type structure, for 0.94 < x < 1 and 0.93 < y < 1. A process of competition between the dominant and the constrained effects of the lone-pair 6s2 of Bi3+ is discussed. The diffuse reflectance spectroscopic studies of these mixed oxides are presented. The observed broad bands are attributed to charge transfer processes and the sharp peaks in the BixEu1−xVO4 spectra are ascribed to intra-configurational 4f – 4ftransitions of the Eu3+ ion. The broad absorption shift in BiLnVO4 (Ln : Eu and Gd) compounds to the longer wavelengths range, when Bi is introduced in the LnVO4 lattice, is ascribed to charge transfer processes in a Bi-VO4 center and are interpreted assuming a Jahn-Teller effect in the excited state of Bi3+. The concept of an internal pressure of Bi3+ ions is also used to explain the broad A-band shifts. 相似文献
95.
De Schutter DP Saison D Delvaux F Derdelinckx G Rock JM Neven H Delvaux FR 《Journal of chromatography. A》2008,1179(2):75-80
The aim of this study was to create a simple, solventless technique without derivatisation in order to analyze a broad range of volatiles in beer wort. A method was developed using headspace solid-phase microextraction coupled with gas chromatography and mass spectrometry. The procedure was optimised by selection of the appropriate fibre and optimisation of extraction temperature, extraction time, and salting-out. The detection limits were well below the actual wort concentrations of the selected volatiles, ranging from 12 ng/l for linalool to 0.53 microg/l for furfural. Moreover, the procedure showed a good linearity and was applied to the analysis of wort samples taken from a wort boiling process in an industrial brewery. 相似文献
96.
97.
Gerd Finke Pierre Lemaire Jean-Marie Proth Maurice Queyranne 《European Journal of Operational Research》2009,199(3):702-705
In this paper, we present a new objective function for scheduling on parallel machines: minimizing the number of machines for schedules of minimum length. We study its complexity and we prove the NP-completeness of this problem, even if there is no precedences or for unitary execution times. We propose several polynomial algorithms for various particular cases. 相似文献
98.
Georgiana Surpateanu Jean-François Soulé Jean-Marie Beau Stéphanie Norsikian Bogdan I. Iorga 《Journal of carbohydrate chemistry》2013,32(2):114-129
The conformational flexibility of two glycal-type neuraminidase inhibitors has been studied, using several molecular modeling techniques. In agreement with the experimental data available, an intramolecular hydrogen bond, representing a key structural feature that controls the conformer distribution in solution, has been identified. The contribution of each substituent to the overall equilibrium was evaluated using simplified derivatives. Additionally, four methods for estimating NMR coupling constants from dihedral angles were evaluated and the Haasnoot method was found to be appropriate for this class of sugars. These results should allow a better understanding of the structural parameters governing physico-chemical properties of glycal-like compounds. Supplemental materials are available for this article. Go to the publisher's online edition of Journal of Carbohydrate Chemistry to view the free supplemental file. 相似文献
99.
100.
Sabir Jacquir Stéphane Binczak Jean-Marie Bilbault Viktor Kazantsev Vladimir Nekorkin 《Nonlinear dynamics》2006,44(1-4):29-36
An electrical circuit is proposed to realize an unidirectional coupling between two cells, mimicking chemical synaptic coupling.
Each cell represents the FitzHugh–Nagumo (FHN) model of neuron with a modified exitability (MFHN). We present experimental
results on frequency doublings and on the chaotic dynamics depending on the coupling strength in a master–slave configuration.
In all experiments, we stress the influence of the coupling strength on the control of the slave neuron. 相似文献