Synthesis, Characterization, AMDET and DOCKING studies of novel diclofenac derivatives containing phenylalanine moiety acting as selective inhibitors against cyclooxygenase (COX-2)

The present work aims to synthesize novel diclofenac derivatives containing L-phenylanline moiety.  In order to gain inhibition actions of  the synthesized compounds against cyclooxygenases, its compounds were docked  into the active sites of (COX-1 and COX-2). The calculations in-silico were predicted that, lowest energies of docked poses for compounds were interacted with residues of active site, perhaps making them possible selective inhibitors against (COX-2) and physiologically  active. The binding scores of some compounds like 7, 12 and 16 were compared with reference drug, and show extensive interactions with the targets, which may considered them a suitable selective inhibitor against   (COX-2). Keywords: Phenylalanine, Diclofenac, COX, DOCKING,  ADMET

Structural, spectral studies and catalytic activity of copper (II) complex of valine-containing polymer

A new copper complex of valine-containing polymer was prepared to mimic an active site center in the metalloenzymes. The valine containing polymer VPAV was prepared by modifying the vinyl pyridine-acrylamide copolymer. The polymer VPAV was investigated using IR, 1H-nmr, and thermal analysis then, the structure was proposed based on the theoretical calculation. The copper complex CuII-VPAV was fully characterized by means of different physicochemical methods such as IR, electronic spectroscopy, EPR and thermal analysis. The catalyst CuII-VPAV was used in the oxidation of poly phenol trihydroxybenzene in the presence and absence of H2O2. The catalysis shows a catalytic efficiency of 1.2 × 104 times in terms of first-order rate constant relative to auto-oxidation of the substrates in an aqueous environment in the presence of H2O2 and under mild conditions. Key words; valine; copolymer; oxidation; polyphenol; modifyin

Sustainable Production of Tomato Plants (Solanum lycopersicum L.) under Low-Quality Irrigation Water as Affected by Bio-Nanofertilizers of Selenium and Copper

Under the global water crisis, utilizing low-quality water sources in agriculture for irrigation has offered an effective solution to address the shortage of water. Using an excess of low-quality water sources may cause serious risks to the environment, which threaten crop safety and human health. Three kinds of irrigation water (0.413, 1.44, and 2.84 dS m−1) were selected under foliar-applied bio-nanofertilizers of selenium (100 mg L−1) and copper (100 mg L−1) in individual and/or combined application. The nanofertilizers were tested on the production of tomato under greenhouse. After harvesting, the quality of tomato yield and soil biology was evaluated. Using saline water for irrigation caused many main features in this study such as increasing the accumulation of salts, soil organic matter, and CaCO3 in soil by 84.6, 32.3, and 18.4%, respectively, compared to control. The highest tomato yield (2.07 kg plant−1) and soluble solids content (9.24%) were recorded after irrigation with low water quality (2.84 dS m−1) and nano-Cu fertilization. The plant enzymatic antioxidants and soil biological activity were decreased in general due to the salinity stress of irrigation water. After 30 days from transplanting, all studied soil biological parameters (soil microbial counts and enzymes) were higher than the same parameters at harvesting (80 days) under different categories of water quality. The values of all soil biological parameters were decreased by increasing water salinity. This study was carried out to answer the question of whether the combined nanofertilizers of selenium and copper can promote tomato production under saline water irrigation. Further investigations are still needed concerning different applied doses of these nanofertilizers

Sustainable Production of Tomato Plants (<i>Solanum lycopersicum</i> L.) under Low-Quality Irrigation Water as Affected by Bio-Nanofertilizers of Selenium and Copper

Under the global water crisis, utilizing low-quality water sources in agriculture for irrigation has offered an effective solution to address the shortage of water. Using an excess of low-quality water sources may cause serious risks to the environment, which threaten crop safety and human health. Three kinds of irrigation water (0.413, 1.44, and 2.84 dS m−1) were selected under foliar-applied bio-nanofertilizers of selenium (100 mg L−1) and copper (100 mg L−1) in individual and/or combined application. The nanofertilizers were tested on the production of tomato under greenhouse. After harvesting, the quality of tomato yield and soil biology was evaluated. Using saline water for irrigation caused many main features in this study such as increasing the accumulation of salts, soil organic matter, and CaCO3 in soil by 84.6, 32.3, and 18.4%, respectively, compared to control. The highest tomato yield (2.07 kg plant−1) and soluble solids content (9.24%) were recorded after irrigation with low water quality (2.84 dS m−1) and nano-Cu fertilization. The plant enzymatic antioxidants and soil biological activity were decreased in general due to the salinity stress of irrigation water. After 30 days from transplanting, all studied soil biological parameters (soil microbial counts and enzymes) were higher than the same parameters at harvesting (80 days) under different categories of water quality. The values of all soil biological parameters were decreased by increasing water salinity. This study was carried out to answer the question of whether the combined nanofertilizers of selenium and copper can promote tomato production under saline water irrigation. Further investigations are still needed concerning different applied doses of these nanofertilizers

DataSheet1_Draft genome analysis for Enterobacter kobei, a promising lead bioremediation bacterium.docx

Lead pollution of the environment poses a major global threat to the ecosystem. Bacterial bioremediation offers a promising alternative to traditional methods for removing these pollutants, that are often hindered by various limitations. Our research focused on isolating lead-resistant bacteria from industrial wastewater generated by heavily lead-containing industries. Eight lead-resistant strains were successfully isolated, and subsequently identified through molecular analysis. Among these, Enterobacter kobei FACU6 emerged as a particularly promising candidate, demonstrating an efficient lead removal rate of 83.4% and a remarkable lead absorption capacity of 571.9 mg/g dry weight. Furthermore, E. kobei FACU6 displayed a remarkable a maximum tolerance concentration (MTC) for lead reaching 3,000 mg/L. To further investigate the morphological changes in E. kobei FACU6 in response to lead exposure, scanning electron microscopy (SEM) and transmission electron microscopy (TEM) were employed. These analyses revealed significant lead adsorption and intracellular accumulation in treated bacteria in contrast to the control bacterium. Whole-genome sequencing was performed to gain deeper insights into E. kobei’s lead resistance mechanisms. Structural annotation revealed a genome size of 4,856,454 bp, with a G + C content of 55.06%. The genome encodes 4,655 coding sequences (CDS), 75 tRNA genes, and 4 rRNA genes. Notably, genes associated with heavy metal resistance and their corresponding regulatory elements were identified within the genome. Furthermore, the expression levels of four specific heavy metal resistance genes were evaluated. Our findings revealed a statistically significant upregulation in gene expression under specific environmental conditions, including pH 7, temperature of 30°C, and high concentrations of heavy metals. The outstanding potential of E. kobei FACU6 as a source of diverse genes related to heavy metal resistance and plant growth promotion makes it a valuable candidate for developing safe and effective strategies for heavy metal disposal.</p