In Silico and Experimental Characterization of Chimeric Bacillus thermocatenulatus Lipase with the Complete Conserved Pentapeptide of Candida rugosa Lipase

Lipases are one of the highest value commercial enzymes as they have broad applications in detergent, food, pharmaceutical, and dairy industries. To provide chimeric Bacillus thermocatenulatus lipase (BTL2), the completely conserved pentapeptide (¹¹²Ala-His-Ser-Gln-Gly¹¹⁶) was replaced with similar sequences (²⁰⁷Gly-Glu-Ser-Ala-Gly²¹¹) of Candida rugosa lipase (CLR) at the nucleophilic elbow region. For this purpose, three mutations including A112G, H113E, and Q115A were inserted in the conserved pentapeptide sequence of btl2 gene. Based on the crystal structures of 2W22, the best structure of opened form of the chimeric lipases were garnered using the MODELLER v9.10 software. The native and chimeric lipases were docked to a set of ligands, and a trial version of Molegro Virtual Docker (MVD) software was used to obtain the energy values. Docking results confirmed chimeric lipase to be better than the native lipase. Following the in silico study, cloning experiments were conducted and expression of native and chimeric btl2 gene in Pichia pastoris was performed. The native and chimeric lipases were purified, and the effect of these mutations on characteristics of chimeric lipase studied and then compared with those of native lipase. Chimeric lipase exhibited 1.6-fold higher activity than the native lipase at 55 °C. The highest percentage of both lipases activity was observed at 60 °C and pH of 8.0. The ion Ca²⁺ slightly inhibited the activity of both lipases, whereas the organic solvent enhanced the lipase stability of chimeric lipase as compared with the native lipase. According to the results, the presence of two glycine residues at the conserved pentapeptide region of this chimeric lipase (¹¹² Gly-Glu-Ser-Ala-Gly ¹¹⁶) may increase the flexibility of the nucleophilic elbow region and affect the enzyme activity level.     

Electroluminescence and Photoluminescence of Conjugated Polymer Films Prepared by Plasma Enhanced Chemical Vapor Deposition of Naphthalene

Polymer light-emitting devices were fabricated utilizing plasma polymerized thin films as emissive layers. These conjugated polymer films were prepared by RF plasma enhanced chemical vapor deposition using naphthalene as monomer. The effect of different applied powers on the chemical structure and optical properties of the conjugated polymers was investigated. Fourier transform infrared (FTIR) and Raman spectroscopies confirmed that a conjugated polymer film with a 3-D cross-linked network was developed. By increasing the power, products tended to form as highly cross-linked polymer films. The fabricated devices showed broadband Electroluminescence (EL) emission peaks with center at 535–550 nm. Photoluminescence (PL) spectra of plasma polymers showed different excimeric emissions, resulted from crosslinked architecture. As the plasma power increased, the optical properties showed two different domains; up to 200 W, EL, PL and UV–Vis spectra red-shifted and broadened significantly. At higher powers, a reverse behavior was observed. Also, the relation between the film structure and plasma species was investigated using optical emission spectroscopy.     

Cr(III)/Cr(VI) speciation in water samples by extractive separation using Amberlite CG-50 and final determination by FAAS

Twenty-five uncultivated surface soil samples collected from the northern and southern regions of Dhaka Export Processing Zone (DEPZ), industrial area of Bangladesh, were analyzed for their contents of Y, lanthanides and natural radionuclides (Th and U) using an inductively coupled plasma mass spectrometer (ICP-MS). Analogous concentrations of the Y, lanthanides, Th and U were observed in the both regions of DEPZ around several kilometer distances. Further, the measured values showed no particular contamination. However, the concentrations of the light lanthanides (La, Ce and Nd) in the Bangladeshi soils were around twice the worldwide average value. But, the smooth curve of the chondrite normalized patterns of the lanthanides suggested that the lanthanide contents of the Bangladeshi soils in this area are the results of the natural dispersion process rather than anthropogenic activities. In addition, the relatively high Th and U concentrations and Th/U ratio were observed in Bangladeshi soils of this area, most likely due to the effect of their parent materials such as clay stones which have a high Th/U ratio. Since this is the first precise result for the Y, lanthanides, Th and U contents in Bangladeshi soils, it could be useful in understanding the background level and the characteristics of these elements in Bangladeshi soils.     

Flotation separation and electrothermal atomic absorption spectrometric determination of lead in water samples

Abstract

The application of macro- and micro-electrodes constructed using the new ionophore were tested in a range of solution compositions reflecting concentrations found in fresh waters, and containing Cl^?, NO₃ ^?, SO₄ ^2-, HCO₃ ^2-, H₄SiO₄ and a natural humic acid. The inhibition of the electrode responses to these ions was quantified using a mixed-solution method by optimising the agreement between the measured potentials and predictions from the Nicolsky-Eisenman equation. In addition, measurements were made in separate solutions of KC1 to enable results to be compared with the literature. Apart from the results obtained for humic acid, mean selectivity coefficients for 16 macro- and 21 micro-electrode experiments are given. The results indicate inhibition of the electrode response to phosphate for all the anions in the concentration ranges of 0.05–1 mM Cl^?, 0.1–1.0 mM NO₃ ^?, 0.1–10.0 mM HCO₃ ^? and 0.1–1.5 mM SO₄ ^2- with high selectivity for HPO₄ ^2- in the presence of both dissolved silicon and a standard humic acid. This means that the application of the electrodes to hard waters is impracticable although studies of soft waters and laboratory studies in controlled conditions, e.g. calcium phosphate precipitation experiments, are feasible.     

Synthesis,crystal structure,and electrochemical properties of Ni(II) and Cu(II) complexes with two unsymmetrical N2O2 Schiff base ligands

Nickel(II) and copper(II) complexes of two unsymmetrical tetradentate Schiff base ligands [Ni(Me-salabza)] (1), [Cu(Me-salabza)] (2) and [Ni(salabza)] (3), {H₂salabza = N,N′-bis[(salicylidene)-2-aminobenzylamine] and H₂Me-salabza = N,N′-bis[(methylsalicylidene)-2-aminobenzylamine]}, have been synthesized and characterized by elemental analysis and spectroscopic methods. The crystal structures of 2 and 3 complexes have been determined by single crystal X-ray diffraction. Both copper(II) and nickel(II) ions adopt a distorted square planar geometry in [Cu(Me-salabza)] and [Ni(salabza)] complexes. The cyclic voltammetric studies of these complexes in dichloromethane indicate the electronic effects of the methyl groups on redox potential.     

Introducing Organic Gas Steam-Liquid Extraction as a New Preconcentration Method for Benzene,Toluene, Ethylbenzene and Xylene Determination in Water Samples by Gas Chromatography-Flame Ionization Detection

Journal of Analytical Chemistry - In this study, for the first time, the organic gas steam-liquid extraction by a special hand-made cell was used as a simple and inexpensive preconcentration...     

Energy and exergy analysis of a novel turbo-compounding system for supercharging and mild hybridization of a gasoline engine

Journal of Thermal Analysis and Calorimetry - Number of hybrid vehicles has increased around the world significantly. Automotive industry is utilizing the hybridization of the powertrain system to...     

A Silver Bite: Crystalline Heterometallic Architectures Based on Ag–π Interactions with a Bis‐Dipyrrin Zinc Helicate

An unprecedented mode of assembly of helical motives and Ag^I ions in the crystalline state is described. The combination of a Zn^II helicate based on a 2,2′‐bisdpm bearing peripheral benzonitrile moieties with AgX salts, leads to the formation of a tetranuclear core containing Ag–π interactions. Depending on the coordinating ability of the X^? anion and the solvents used, the tetranuclear complex self‐assembles into coordination polymers of varying dimensionality. From the sequence of coordination events (Ag–π or Ag–peripheral site), one may envisage two possible construction scenarios. However, the Ag–π as primary event seems reasonable owing to the rather weak binding propensity of the nitrile group and the chelating nature of the π‐clefts.     

A facile electrochemical method for the synthesis of new sulfonamide derivatives of potential biological significance

The electrochemical synthesis of some new sulfonamide derivatives was carried out via the electrochemical oxidation of 2,3-dihydrophthalazine-l,4-dione （1） in the presence of arylsulfinic acids （2a and 2b） as nucleophiles. The results show that, the electrogenerated phthalazine-l,4-dione （lox） participates in a Michael type addition reaction with 2a or 2b and via an EC mechanism to produce the corresponding sulfonamide derivatives. This method provides a one-pot procedure for the synthesis of new sulfonamide derivatives of potential biological significance in good yields without using toxic reagents at a carbon electrode in an environmentally friendly manner.