The title complex, (C(8)H(20)N)[Co(CN)(4)(C(10)H(8)N(2))]·CH(3)CN·1.5H(2)O, consists of tetra-ethyl ammonium cations, mononuclear [Co(III)bpy(CN)(4)](-) anions and uncoordinated water and acetonitrile mol-ecules. The Co(III) atom is six-coordinated by two 2,2'-bipyridine (bpy) N atoms and four cyanide C atoms in a distorted octa-hedral geometry. The acute bite angle of the chelating bpy [82.28 (8)°] is the main factor accounting for this distortion. In addition, the tetra-ethyl-ammonium cation is significantly disordered [occupancy ratio 0.611 (3):0.389 (3)]. The presence of water mol-ecules, one of which is disordered over two positions about an inversion center, results in the formation of a network of O-H⋯N hydrogen bonds involving the cyanide N atoms.
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http://dx.doi.org/10.1107/S1600536810011311 | DOI Listing |
Int J Biol Macromol
December 2024
Key Laboratory of Food Processing and Quality Control, College of Food Science and Technology, Nanjing Agricultural University, Nanjing 210000, PR China. Electronic address:
Transport proteins are essential for bacterial resistance to antibiotics and toxins, but their mechanisms remain poorly understood in Bacillus subtilis. In the present study, overexpression of yoeA enhanced resistance to various antibiotics, with its expression induced by these antibiotics, especially penicillin and plipastatin. The ΔyoeA strain exhibited significant growth inhibition at 100 μg/mL of plipastatin, while as high as 10,000 μg/mL of iturin/surfactin are required to achieve comparable inhibition, suggesting a higher sensitivity of ΔyoeA to plipastatin.
View Article and Find Full Text PDFACS Catal
November 2024
Institute for Biochemistry, Biotechnology and Bioinformatics, Technische Universität Braunschweig, Spielmannstr. 7, 38106 Braunschweig, Germany.
Halohydrin dehalogenase HheG and its homologues are remarkable enzymes for the efficient ring opening of sterically demanding internal epoxides using a variety of nucleophiles. The enantioselectivity of the respective wild-type enzymes, however, is usually insufficient for application and frequently requires improvement by protein engineering. We herein demonstrate that the highly flexible N-terminal loop of HheG, comprising residues 39 to 47, has a tremendous impact on the activity as well as enantioselectivity of this enzyme in the ring opening of structurally diverse epoxide substrates.
View Article and Find Full Text PDFChem Sci
October 2024
Smart Innovation Program, Graduate School of Advanced Science and Engineering, Hiroshima University Higashi-Hiroshima Hiroshima 739-8527 Japan
Overcrowded bistricyclic aromatic enes (BAEs) have several conformational isomers, including twisted and -folded conformers. These compounds change color depending on their conformation because each isomer exhibits distinct absorption bands. In this study, we introduced several heteroatoms such as boron and silicon into BAEs to control the energy difference between the twisted and -folded conformers, thereby achieving chromic properties.
View Article and Find Full Text PDFJ Mol Model
October 2024
Department of Chemistry and Biochemistry, DePaul University, Chicago, IL, 60614, USA.
Context: The strength and nature of the two halogen bonds in the NCI···CHI···CN halogen-bonded ternary complex are studied in the gas phase via ab initio calculations. Different indicators of halogen bond strength were employed to examine the interactions including geometries, complexation energies, Natural Bond Order (NBO) Wiberg bond indices, and Atoms in Molecules (AIM)-based charge density topological properties. The results show that the halogen bond is strong and partly covalent in nature when CHI donates the halogen bond, but weak and noncovalent in nature when CHI accepts the halogen bond.
View Article and Find Full Text PDFSci Rep
September 2024
Department of Chemistry, Khalifa University of Science and Technology, P.O. Box 127788, Abu Dhabi, UAE.
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