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991.
Robin C. E. Deutscher M. Safa Karagöz Dr. Patrick L. Purder Dr. Jürgen M. Kolos Dr. Christian Meyners Wisely Oki Sugiarto Patryk Krajczy Frederike Tebbe Thomas M. Geiger Dr. Can Ünal Prof. Dr. Ute A. Hellmich Prof. Dr. Michael Steinert Prof. Dr. Felix Hausch 《Chembiochem : a European journal of chemical biology》2023,24(21):e202300442
Legionella pneumophila is the causative agent of Legionnaires’ disease, a serious form of pneumonia. Its macrophage infectivity potentiator (Mip), a member of a highly conserved family of FK506-binding proteins (FKBPs), plays a major role in the proliferation of the gram-negative bacterium in host organisms. In this work, we test our library of >1000 FKBP-focused ligands for inhibition of LpMip. The [4.3.1]-bicyclic sulfonamide turned out as a highly preferred scaffold and provided the most potent LpMip inhibitors known so far. Selected compounds were non-toxic to human cells, displayed antibacterial activity and block bacterial proliferation in cellular infection-assays as well as infectivity in human lung tissue explants. The results confirm [4.3.1]-bicyclic sulfonamides as anti-legionellal agents, although their anti-infective properties cannot be explained by inhibition of LpMip alone. 相似文献
992.
Chenghao Li Dai Shi Andrea K. Stone Yixiao Wang Janitha P. D. Wanasundara Takuji Tanaka Michael T. Nickerson 《Journal of the American Oil Chemists' Society》2023,100(7):529-538
In this study, the effects of solid-state fermentation (SSF), including strain (Aspergillus niger NRRL 334 and A. oryzae NRRL 5590) and fermentation time (24, 48, and 72 h) on the nutritional value of cold-pressed (CP) and hexane-extracted (HE) canola meals were examined. SSF increased the protein content of both types of meals (from ~36% to ~40%) while reducing the oil content of CP meals (from ~12% to 9%). There was a significant reduction (~80%) in the phytic acid content of both types of meals after fermentation using either fungi. Overall, fermented samples showed a decrease in the total phenolic content from 2.7–3.1 to ~1.0 mg gallic acid equivalents (GAE)/g dry meal (DM) (a ~65% reduction), of which specifically the HE meal fermented with A. niger sample had the greatest decrease from 3.1 to 0.6 mg GAE/g DM (~81% reduction). Seventy-two hours of fermentation decreased the in vitro protein digestibility (IVPD) of A. oryzae fermented meals. In contrast, a shorter fermentation time (24 h) increased the IVPD for most samples as compared to the controls (from ~72%–73% to 77%–81%), with the exception of the CP meal fermented with A. niger which had similar IVPD at all fermentation times. Overall, the changes indicate that SSF using A. niger or A. oryzae can be useful to positively modify the composition of different canola meals and improve their nutritional value by significantly increasing the protein content, decreasing the levels of antinutrients, while only slightly reducing IVPD. 相似文献
993.
Dr. Shinpei Uno Dr. Alexander H. Harkiss Dr. Roy Chowdhury Dr. Stuart T. Caldwell Tracy A. Prime Dr. Andrew M. James Dr. Brendan Gallagher Dr. Julien Prudent Prof. Dr. Richard C. Hartley Prof. Dr. Michael P. Murphy 《Chembiochem : a European journal of chemical biology》2023,24(11):e202200774
The targeting of bioactive molecules and probes to mitochondria can be achieved by coupling to the lipophilic triphenyl phosphonium (TPP) cation, which accumulates several hundred-fold within mitochondria in response to the mitochondrial membrane potential (Δψm). Typically, a simple alkane links the TPP to its “cargo”, increasing overall hydrophobicity. As it would be beneficial to enhance the water solubility of mitochondria-targeted compounds we explored the effects of replacing the alkyl linker with a polyethylene glycol (PEG). We found that the use of PEG led to compounds that were readily taken up by isolated mitochondria and by mitochondria inside cells. Within mitochondria the PEG linker greatly decreased adsorption of the TPP constructs to the matrix-facing face of the mitochondrial inner membrane. These findings will allow the distribution of mitochondria-targeted TPP compounds within mitochondria to be fine-tuned. 相似文献
994.
Asanka P. Basnayake Juan P. Hidalgo Byron Villacorta Kameron G. Dunn Michael T. Heitzmann 《火与材料》2023,47(1):28-50
The interactions of Calcium carbonate (e.g., eggshell powder) and Lignin with ammonium polyphosphate (APP) when used as fire retardants were investigated. Three mixing ratios - 1:3, 1:1, and 3:1, were used with natural fibre reinforced composites containing a hemp mat and an epoxy matrix manufactured using a light resin transfer moulding (L-RTM) process. The thermal decomposition of the retardant mixtures and composites was investigated using thermogravimetric analysis (TGA). The findings showed that even though the decomposition reactions of APP with eggshell powder and lignin mixtures interacted and overlapped, the same interactions could not be seen in the composites. In the composite form while the residue was affected by the retardant, the decomposition reactions were driven primarily by the hemp and epoxy. Flammability of the composites was studied by testing to 20, 35, 50, and 75 kW/m2 with a cone calorimeter, and determining the critical heat flux. While the samples with eggshell powder had higher ignition times, the critical heat flux for ignition was 13 kW/m2 for all sample groups except for a ratio of 1:3 APP to eggshell powder, which was 14 kW/m2. The lowest burning rates (mass loss and heat release) occurred in composites containing only APP, however, the addition of eggshell powder or lignin at even a ratio of 3:1 APP to either provided a notable reduction. 相似文献
995.
Elisabeth Koch Mustafa Bagci Michael Kuhn Nicole M. Hartung Malwina Mainka Katharina M. Rund Nils Helge Schebb 《Lipids》2023,58(1):41-56
Oxysterols play a key role in many (patho)physiological processes and they are potential biomarkers for oxidative stress in several diseases. Here we developed a rapid gas chromatographic-mass spectrometry-based method for the separation and quantification of 11 biologically relevant oxysterols bearing hydroxy, epoxy, and dihydroxy groups. Efficient chromatographic separation (resolution ≥ 1.9) was achieved using a medium polarity 35%-diphenyl/65%-dimethyl polysiloxane stationary phase material (30 m × 0.25 mm inner diameter and 0.25 μm film thickness). Based on thorough analysis of the fragmentation during electron ionization we developed a strategy to deduce structural information of the oxysterols. Optimized sample preparation includes (i) extraction with a mixture of n-hexane/iso-propanol, (ii) removal of cholesterol by solid phase extraction with unmodified silica, and (iii) trimethylsilylation. The method was successfully applied on the analysis of brain samples, showing consistent results with previous studies and a good intra- and interday precision of ≤20%. Finally, we used the method for the investigation of oxysterol formation during oxidative stress in HepG2 cells. Incubation with tert-butyl hydroperoxide led to a massive increase in free radical formed oxysterols (7-keto-chol > 7β-OH-chol >> 7α-OH-chol), while 24 h incubation with the glutathione peroxidase 4 inhibitor RSL3 showed no increase in oxidative stress based on the oxysterol pattern. Overall, the new method described here enables the robust analysis of a biologically meaningful pattern of oxysterols with high sensitivity and precision allowing us to gain new insights in the biological formation and role of oxysterols. 相似文献
996.
Dr. Florian C. Schrader Dr. Serghei Glinca Dr. Julia M. Sattler Dr. Hans‐Martin Dahse Gustavo A. Afanador Prof. Dr. Sean T. Prigge Prof. Dr. Michael Lanzer Dr. Ann‐Kristin Mueller Prof. Dr. Gerhard Klebe Prof. Dr. Martin Schlitzer 《ChemMedChem》2013,8(3):442-461
Malaria is a potentially fatal disease caused by Plasmodium parasites and poses a major medical risk in large parts of the world. The development of new, affordable antimalarial drugs is of vital importance as there are increasing reports of resistance to the currently available therapeutics. In addition, most of the current drugs used for chemoprophylaxis merely act on parasites already replicating in the blood. At this point, a patient might already be suffering from the symptoms associated with the disease and could additionally be infectious to an Anopheles mosquito. These insects act as a vector, subsequently spreading the disease to other humans. In order to cure not only malaria but prevent transmission as well, a drug must target both the blood‐ and pre‐erythrocytic liver stages of the parasite. P. falciparum (Pf) enoyl acyl carrier protein (ACP) reductase (ENR) is a key enzyme of plasmodial type II fatty acid biosynthesis (FAS II). It has been shown to be essential for liver‐stage development of Plasmodium berghei and is therefore qualified as a target for true causal chemoprophylaxis. Using virtual screening based on two crystal structures of PfENR, we identified a structurally novel class of FAS inhibitors. Subsequent chemical optimization yielded two compounds that are effective against multiple stages of the malaria parasite. These two most promising derivatives were found to inhibit blood‐stage parasite growth with IC50 values of 1.7 and 3.0 μM and lead to a more prominent developmental attenuation of liver‐stage parasites than the gold‐standard drug, primaquine. 相似文献
997.
998.
The less polar π‐surface of protein amide groups is exposed in many receptor binding sites, either as part of the backbone or in Gln/Asn side chains. Using quantum chemical calculations and Protein Data Bank (PDB) searches on model systems, we investigate the energetics and geometric preferences for the stacking on amide groups of a large number of heteroarenes that are relevant to medicinal chemistry. From this study, we discern that the stacking energy of an aromatic ligand substituent can be improved by: 1) orienting the fragment dipole vector such that it is aligned in an antiparallel fashion with the dipole of the interacting protein amide group, 2) increasing its dipole moment, and 3) decreasing its π‐electron density. These guidelines should be helpful to more rationally exploit this interaction type in future structure‐based drug design. 相似文献
999.
Dr. Stefan Peukert Dr. Feng He Miao Dai Rui Zhang Yingchuan Sun Dr. Karen Miller‐Moslin Michael McEwan Dr. Bharat Lagu Kate Wang Dr. Naeem Yusuff Aaron Bourret Arun Ramamurthy Dr. Wieslawa Maniara Adam Amaral Anthony Vattay Anlai Wang Ribo Guo Jing Yuan John Green Dr. Juliet Williams Dr. Silvia Buonamici Dr. Joseph F. Kelleher III Dr. Marion Dorsch 《ChemMedChem》2013,8(8):1261-1265
1000.
Dispersion polymerization of styrene has been performed in CO2-expanded ethanol at ≤9 MPa and 70 °C using PVP as stabilizer. The polymerizations proceeded with good colloidal stability, resulting in spherical particles of diameters of ∼2 μm. Pressurization with CO2 leads to an increase in particle size (∼1 μm in the corresponding CO2-free system), and a decrease in both polymerization rate and molecular weight. The main effect of CO2 is proposed to be its influence on the partitioning of monomer between the continuous and the particle phase–the results indicate that CO2-pressurization causes a reduction in monomer concentration in the particles. Overall, the results are consistent with literature data on the effects of the polarity of the continuous phase in dispersion polymerization of styrene in alcohols and alcohol/water mixtures. 相似文献