Role of Nonplanar Peptide Unit in Regular Polypeptide Helices - New Model for Pply-Beta-Benzyl-L-Aspartate

The effect of non-planarity of the peptide unit on helical structures stabilized by intrachain hydrogen bonds is discussed. While the present calculations generally agree with those already reported in the literature for right-handed helical structures, it is found that the most stable left-handed structure is a novel helix, called the delta-helix. Its helical parameters are close to these reported for poly-beta-benzyl-L -aspartate. Conformational energy calculations show that poly-beta-benzyl-L -aspartate with the delta-helical structure is considerably more stable than the structure it is generally believed to take up (the omega-helix) by about 15 kcal/mol-residue.

The role of intra- and inter-site exchange correlations in the extended Falicov-Kimball model on a triangular lattice

Ground state magnetic properties of the spin-dependent Falicov-Kimball model (FKM) are studied by incorporating the intrasite exchange correlation J (between itinerant d- and localized f-electrons) and intersite (superexchange) correlation J (between localized f-electrons) on a triangular lattice for two different fillings. Numerical diagonalization and Monte-Carlo techniques are used to determine the ground state magnetic properties. Transitions from antiferromagnetic to ferromagnetic and again to re-entrant antiferromagnetic phase is observed in a wide range of parameter space. The magnetic moments of d- and f-electrons are observed to depend strongly on the value off, J and also on the total number of d-electrons (N-d). (C) 2015 Elsevier Ltd. All rights reserved.

Physiological role of FolD (methylenetetrahydrofolate dehydrogenase), FchA (methenyltetrahydrofolate cyclohydrolase) and Fhs (formyltetrahydrofolate synthetase) from Clostridium perfringens in a heterologous model of Escherichia coli

Most organisms possess bifunctional FolD 5,10-methylenetetrahydrofolate (5,10-CH2-THF) dehydrogenase-cyclohydrolase] to generate NADPH and 10-formyltetrandrofolate (10-CHO-THF) required in various metabolic steps. In addition, some organisms including Clostridium perfringens possess another protein, Fhs (formyltetrahydrofolate synthetase), to synthesize 10-CHO-THF. Here, we show that unlike the bifunctional FolD of Escherichia coli (Eco FolD), and contrary to its annotated bifunctional nature, C. perfringens FolD (Cpe FoID) is a monofunctional 5,10-CH2-THF dehydrogenase. The dehydrogenase activity of Cpe FoID is about five times more efficient than that of Eco FolD. The 5,10-methenyltetrahydrofolate (5,10-CH+-THF) cyclohydrolase activity in C. perfringens is provided by another protein, FchA (5,10-CH+-THF cyclohydrolase), whose cyclohydrolase activity is similar to 10 times more efficient than that of Eco FolD. Kinetic parameters for Cpe Fhs were also determined for utilization of all of its substrates. Both Cpe FoID and Cpe FchA are required to substitute for the single bifunctional FolD in E. coli. The simultaneous presence of Cpe FoID and Cpe FchA is also necessary to rescue an E coli folD deletion strain (harbouring Cpe Fhs support) for its formate and glycine auxotrophies, and to alleviate its susceptibility to trimethoprim (an antifolate drug) or UV light. The presence of the three clostridial proteins (FolD, FchA and Fhs) is required to maintain folate homeostasis in the cell.

An Experimental Study of Kerosene Combustion in a Supersonic Model Combustor Using Effervescent Atomization

Investigation of kerosene combustion in a Mach 2.5 flow was carried out using a model supersonic combustor with cross-section area of 51 mm × 70 mm and different integrated fuel injector/flameholder cavity modules. Experiments with pure liquid atomization and with effervescent atomization were characterized and compared. Direct photography, Schlieren imaging, and planar laser induced fluorescence (PLIF) imaging of OH radical were utilized to examine the cavity characteristics and spray structure. Schlieren images illustrate the effectiveness of gas barbotage in facilitating atomization and the importance of secondary atomization when kerosene sprays interacting with a supersonic crossflow. OH PLIF images further substantiate our previous finding that there exists a local high-temperature radical pool within the cavity flameholder, and this radical pool plays a crucial role in promoting kerosene combustion in a supersonic combustor. Under the same operation conditions, comparison of the measured static pressure distributions along the combustor also shows that effervescent atomization generally leads to better combustion performance than the use of pure liquid atomization. Furthermore, the present results demonstrate that the cavity characteristics can be different in non-reacting and reacting supersonic flows. As such, the conventional definition of cavity characteristics based on non-reacting flows needs to be revised.

An Experimental Study of Kerosene Combustion in a Supersonic Model Combustor Using Effervescent Atomization

Investigation of kerosene combustion in a Mach 2.5 flow was carried out using a model supersonic combustor with cross-section area of 51 mm?70 mm, with special emphases on the characterization of effervescent atomization and the flameholdering mechanism using different integrated fuel injector/flameholder cavity modules. Direct photography, Schlieren imaging, and Planar Laser Induced Fluorescence (PLIF) imaging of OH were utilized to examine the cavity characteristics and spray structure, with and without gas barbotage. Schlieren images illustrate the effectiveness of gas barbotage in facilitating atomization and the importance of secondary atomization when kerosene sprays interacting with a supersonic crossflow. OH-PLIF images further substantiate our previous finding that there exists a local high temperature radical pool within the cavity flameholder and this radical pool plays a crucial role in promoting kerosene combustion in a supersonic combustor. The present results also demonstrate that the cavity characteristics can be different in non-reacting and reacting supersonic flows. As such, the conventional definition of cavity characteristics based on non-reacting flows needs to be revised.