Quantum chemical modeling of the thermodynamics of the formation of Au(III), Pd(II), and Pt(II) chloride complexes.

Quantitative prediction of physical properties of liquids and equilibrium constants is important for many applications. Computational methods based on either explicit or implicit solvent models can be used to approximate thermodynamics of complexation. A practical method for calculating the stability constant of d chlorocomplexes (PdCl, PtCl, AuCl) in aqueous solution has been developed by using DFT and DLPNO-CCSD with the SMD solvation model and 100 unique explicit water molecules.

Crystal structure of semi-synthetic obelin-v after calcium induced bioluminescence implies coelenteramine as the main reaction product.

Coelenterazine-v (CTZ-v), a synthetic vinylene-bridged π-extended derivative, is able to significantly alter bioluminescence spectra of different CTZ-dependent luciferases and photoproteins by shifting them towards longer wavelengths. However, Ca-regulated photoproteins activated with CTZ-v display very low bioluminescence activities that hampers its usage as a substrate of photoprotein bioluminescence. Here, we report the crystal structure of semi-synthetic Ca-discharged obelin-v bound with the reaction product determined at 2.

Composition and Structure of Aspen () Hemicelluloses Obtained by Oxidative Delignification.

In this study, hemicelluloses of aspen wood () were obtained by oxidative delignification in an acetic acid-water-hydrogen peroxide medium at temperatures of 70-100 °C and a process time of 1-4 h. The maximum polysaccharide yield of up to 9.68 wt% was reported.

Resorbable Nanomatrices from Microbial Polyhydroxyalkanoates: Design Strategy and Characterization.

From a series of biodegradable natural polymers of polyhydroxyalkanoates (PHAs)-poly-3-hydroxybutyrate (P(3HB) and copolymers containing, in addition to 3HB monomers, monomers of 3-hydroxyvalerate (3HV), 3-hydroxyhexanoate (3HHx), and 4-hydroxybutyrate (4HB), with different ratios of monomers poured-solvent casting films and nanomembranes with oriented and non-oriented ultrathin fibers were obtained by electrostatic molding. With the use of SEM, AFM, and measurement of contact angles and energy characteristics, the surface properties and mechanical and biological properties of the polymer products were studied depending on the method of production and the composition of PHAs. It has been shown in cultures of mouse fibroblasts of the NIH 3T3 line and diploid human embryonic cells of the M22 line that elastic films and nanomembranes composed of P(3HB-co-4HB) copolymers have high biocompatibility and provide adhesion, proliferation and preservation of the high physiological activity of cells for up to 7 days.

Features of Peripheral Blood Th-Cell Subset Composition and Serum Cytokine Level in Patients with Activity-Driven Ankylosing Spondylitis.

Th cells may exhibit pathological activity depending on the regulatory and functional signals sensed under a wide range of immunopathological conditions, including ankylosing spondylitis (AS). The relationship between Th cells and cytokines is important for diagnoses and for determining treatment. Accordingly, the aim of this study was to investigate the relationship between Th-cell subset composition and serum cytokine profile for patients with activity-driven AS.

Impact of Hydrodynamic Cavitation on the Properties of Coal-Water Fuel: An Experimental Study.

It is common to use coal as raw material in heat power engineering. A number of shortcomings of coal such as ignitability cannot be easily eliminated. The use of water-slurry-based coal-water fuel instead of coal eliminates this problem.

On the Ways of Forest Typology Researches in Siberia in the 1960s-2000s.

The article presents a brief overview of the works on forest typology and zoning of Siberia conducted at the Forest Typology Laboratory of the Institute of Forest and Timber of the USSR Academy of Sciences, later Sukachev Institute of Forest of the Siberian Branch of the Russian Academy of Sciences. The ecological and phytocoenotic line of research and the regional approach to the creation of diagnostic tables of forest types were adopted as a basis for complex field work carried out jointly with forest management throughout Siberia. The principal features of forest typological work in mountains required the improvement of the system of classification units and mapping of forest cover with determining their diagnostic indicators.

Comparative Study of Plutonium and Radiocaesium Content in the Muscle of Fish of the Yenisey River.

This work reports the first data on the content of plutonium (Pu) in the muscle tissues of the Northern pike (Esox lucius) and the Siberian dace (Leiciscus baicalensis) inhabiting the middle reaches of the Yenisey River in the vicinity of the radioactive discharge site. An increase in the content of Pu and radiocaesium (Cs) in pike muscles followed an increase in the volume of controlled discharges of these radionuclides to the Yenisey in 2018. The content of Pu in the muscles of pike (2-11 mBq/kg dry weight) and dace (1-4 mBq/kg dry weight) of the Yenisey fall within the range of values obtained by other authors for the ichthyofauna from water bodies contaminated with radioactive discharges from nuclear power plants and spent nuclear fuel processing plants.

Biosynthesis and Properties of a P(3HB--3HV--4HV) Produced by B-10646.

Synthesis of P(3HB--3HV--4HV) copolymers by the wild-type strain B-10646 on fructose or sodium butyrate as the main C-substrate with the addition of γ-valerolactone as a precursor of 3HV and 4HV monomers was studied. Bacterial cells were cultivated in the modes that enabled production of a series of copolymers with molar fractions of 3HV (from 7.3 to 23.

An Efficient Method of Birch Ethanol Lignin Sulfation with a Sulfaic Acid-Urea Mixture.

For the first time, the process of birch ethanol lignin sulfation with a sulfamic acid-urea mixture in a 1,4-dioxane medium was optimized experimentally and numerically. The high yield of the sulfated ethanol lignin (more than 96%) and containing 7.1 and 7.

Cenosphere-Based Zeolite Precursors of Lutetium Encapsulated Aluminosilicate Microspheres for Application in Brachytherapy.

Coal fly ash hollow aluminosilicate microspheres (cenospheres) of stabilized composition (glass phase-95.4; (SiO/AlO)-3.1; (Si/Al) = 2.

[Effect of the elimination diet in psoriasis: a clinical case].

Psoriasis (PS) is a multifactorial disease with a dominant role of genetic predisposition, but the questions of PS etiology and pathogenesis still remain open. The development of PS can be facilitated by environmental factors, as well as a violation of the skin barrier and immune imbalance. In the literature of recent years, an association in clinical practice between PS and atopic diseases (atopic dermatitis, bronchial asthma, allergic rhinitis) has been increasingly reported.

"Bioluminescence and Photonics of Fluorescent Proteins" session at the 9th Congress of the Russian Photobiology Society (Shepsi, Krasnodar region, Russia; September 12-19, 2021).

Here is a brief summary of presentations made by the participants of the "Bioluminescence and Photonics of Fluorescent Proteins" session at the 9th Congress of the Russian Photobiological Society which were dedicated to basic studies on bioluminescence systems of different organisms as well as to various analytical applications of bioluminescent proteins. Many questions to the speakers and in-depth and comprehensive discussion of the results obtained demonstrated the researchers' interest in this field of Photobiology.

Degradable Poly(3-hydroxybutyrate)-The Basis of Slow-Release Fungicide Formulations for Suppressing Potato Pathogens.

Three-component slow-release fungicide formulations with different modes of action of the active ingredients for suppressing potato pathogens were constructed for the first time. The difenoconazole, mefenoxam, prothioconazole, and azoxystrobin fungicides were embedded in the degradable polymer P(3HB)/birch wood flour blend and examined using SEM, IR spectroscopy, X-ray analysis, DTA, and DSC. Results showed that no chemical bonds were established between the components and that they were physical mixtures that had a lower degree of crystallinity compared to the initial P(3HB), which suggested different crystallization kinetics in the mixtures.

Study of the Effect of Modified Aluminum Oxide Nanofibers on the Properties of PLA-Based Films.

To find out whether AlO nanofiller is effective in improving the characteristics of polymer composites, composite polymer films based on biodegradable polylactide and epoxidized aluminum oxide nanofibers were obtained by solution casting. Surface morphology, mechanical and thermal properties of composites were studied by SEM, IR-Fourier spectroscopy, DSC and DMA. It was shown that, below and above the percolation threshold, the properties of the films differ significantly.

Effectiveness of slow-release fungicide formulations for suppressing potato pathogens.

Background: For the first time, the biological activity of slow-release fungicide formulations for suppressing potato pathogens deposited in a degradable poly-3-hydroxybutyrate/sawdust base has been obtained and investigated.

Results: The slow-release fungicide formulations (azoxystrobin, azoxystrobin + mefenoxam, and difenoconazole) were studied in vitro and in vivo in comparison with commercial analogues. In in vitro cultures of phytopathogens, the deposited fungicides showed an inhibitory effect comparable to commercial analogues, limiting the growth of colonies of Phytophthora infestans, Alternaria longipes, Rhizoctonia solani and Fusarium solan (2.

The Role of Immunoglobulin G (IgG), IgA and IgE-Antibodies against in the Development of Oxidative Stress in Patients with Chronic Gastritis.

Aim: To study the predominant serum responses (antibodies IgG, IgA, IgE) against H. pylori in relation to the indicators of the system “lipid peroxidation−antioxidant system” in various pathogenetic variants of chronic gastritis (CG). Materials and Methods: Sixty patients with CG, 33 patients with chronic atrophic gastritis (CAG) and 31 patients with chronic allergic gastritis (CALG) were examined.

Со-60 as a time marker to date sediment layers and estimate sediment transport distances during the 2006 flood event on the Yenisei River.

The study of bottom sediments collected from the Yenisei River downstream of the Mining-and-Chemical Combine (MCC) conducted from 2006 to 2016 revealed increased concentrations of Co, which was present in dispersed form and in the form of radioactive microparticles, in the upper core layers. The increase in Co activity concentration occurred when the 2006 extreme flood on the Yenisei washed away the radionuclide-containing soil from the riverbank at the MCC. The Cs/Co ratio in the upper layers of bottom sediments after the 2006 flood varied between 0.

Annotation of Siberian Larch ( Ledeb.) Nuclear Genome-One of the Most Cold-Resistant Tree Species in the Only Deciduous GENUS in .

The recent release of the nuclear, chloroplast and mitochondrial genome assemblies of Siberian larch ( Ledeb.), one of the most cold-resistant tree species in the only deciduous genus of Pinaceae, with seasonal senescence and a rot-resistant valuable timber widely used in construction, greatly contributed to the development of genomic resources for the larch genus. Here, we present an extensive repeatome analysis and the first annotation of the draft nuclear Siberian larch genome assembly.

Recombinant light-sensitive photoprotein berovin from ctenophore Beroe abyssicola: Bioluminescence and absorbance characteristics.

The bright bioluminescence of ctenophores inhabiting the oceans worldwide is caused by light-sensitive Ca-regulated photoproteins. By now, the cDNAs encoding photoproteins from the four different ctenophore species have been cloned and the recombinant proteins have been characterized to some extent. In this work, we report on the specific activity and the quantum yield of bioluminescence reaction as well as the absorbance characteristics of high-purity recombinant berovin.

Nucleic Acid Aptamers Increase the Anticancer Efficiency and Reduce the Toxicity of Cisplatin-Arabinogalactan Conjugates .

Cisplatin is an effective drug for treating various cancer types. However, it is highly toxic for both healthy and tumor cells. Therefore, there is a need to reduce its therapeutic dose and increase targeted bioavailability.

Evaluation of the effect of background electrolyte composition and independence of parameters in determining binding constants of betulin derivatives to β- and dimethyl-β-cyclodextrins by affinity capillary electrophoresis.

The values of the apparent binding constants for β-cyclodextrin complexes of betulin derivatives determined by mobility shift affinity capillary electrophoresis were found to be independent of the composition of the two background electrolytes used (tetraborate buffer, pH 9.18, and phosphate buffer, pH 8.00, both of them with 20 mM ionic strength).

Droplet Microfluidic Device for Chemoenzymatic Sensing.

The rapid detection of pollutants in water can be performed with enzymatic probes, the catalytic light-emitting activity of which decreases in the presence of many types of pollutants. Herein, we present a microfluidic system for continuous chemoenzymatic biosensing that generates emulsion droplets containing two enzymes of the bacterial bioluminescent system (luciferase and NAD(P)H:FMN-oxidoreductase) with substrates required for the reaction. The developed chip generates "water-in-oil" emulsion droplets with a volume of 0.

Production of Copepod Luciferases via Baculovirus Expression System.

Secreted copepod luciferases (CopLucs) represent highly homologous enzymes which catalyze the oxidation of a low molecular weight substrate, coelenterazine, with the emission of blue light (λ = 485-488 nm), that is called bioluminescence (BL). The well-studied Gaussia (GLuc) and Metridia (MLuc) luciferases originally cloned from the marine copepods Gaussia princeps and Metridia longa belong to the group of the smallest natural luciferases. Their minimal molecular weight, high luminescent activity, cofactor-independent BL, and the ability to be secreted due to the own signal peptide open up the horizons for genetic engineering of CopLuc-based sensitive biosensors for in vivo imaging and in vitro analytical applications.

Production of Metridia Luciferase in Native Form by Oxidative Refolding from E. coli Inclusion Bodies.

The small coelenterazine-dependent luciferase from Metridia longa (MLuc), in view of its high activity, simplicity of bioluminescent (BL) reaction, and stability, has found successful analytical applications as a genetically encoded reporter for in vivo assessment of cellular processes. However, the study on the biochemical and BL properties and the development of in vitro analytical applications of MLuc are hampered by the difficulties of obtaining a sufficient amount of the highly active recombinant protein due to the presence of multiple (up to five) disulfide bonds per molecule. Here, we present a protocol to obtain the recombinant disulfide-rich MLuc using a cheap and simple Escherichia coli expression system without any affinity tags in its native form by refolding from inclusion bodies.