[Effects of Microbial Activities on Mercury Methylation in Farmland near Mercury Mining Area].

In order to study the main effect of microbial activities on mercury(Hg) methylation in farmland, mercury contaminated upland soils and paddy soils near Hg mining area were sampled as experimental soils. Four treatments were designed including only sterilization as the control, accelerating the activities of sulfate reducing bacteria(SRB), inhibiting the SRB's activities, and accelerating the activities of iron-reducing bacteria(FeRB), to know the effects of microbial and non-microbial factors on mercury methylation in soils. The results were as follows:the highest concentration of methylmercury(MeHg) was observed in soils with SRB accelerated treatment, and the increments of MeHg concentrations in upland soils and paddy soils ranged from 0.15 µg·kg-1 to 0.38 µg·kg-1 and 1 µg·kg-1 to 2 µg·kg-1, respectively. Comparatively, little increments of MeHg concentration were seen in soils with SRB inhibited treatment and FeRB accelerated treatment, which were lower than 0.025 µg·kg-1. Compared with upland soils, more MeHg was formed in Paddy soils and the concentrations of MeHg in paddy soils were 4-9 times of that in upland soils. Variation in the number of SRB in soils was similar to that in the concentration of MeHg in soils, and the number of SRB was positively correlated with the concentration of MeHg concentrations in soils(R2=0.57,P<0.01). The above results indicated that activities of reducing bacteria, especially SRB, played key role in the methylation in soils. In addition, more attention should be paid to paddy soils due to the high potential of methylation when conducting any assessment and taking any measure to manage the health risk caused by the exposure to mercury.

Association mechanism of S-dinitrophenyl glutathione with two glutathione peroxidase mimics: 2, 2 cent-ditelluro- and 2, 2 cent-diseleno-bridged b-cyclodextrins.

Complex formation of the glutathione peroxidase mimics 2,2 cent-ditelluro-bridged b-cyclodextrin (1) and 2,2 cent-diseleno-bridged b-cyclodextrin (2), with S-substituted dinitrophenyl glutathione (3) were determined by ultraviolet-visible (UV-Vis) absorption spectroscopy in phosphate buffer (pH 7.4) and (1)H-NMR spectroscopy. Molecular mechanics (MM2) modeling calculations were used to deduce a three-dimensional model for each complex. The dinitrophenyl (DNP) group of 3 appears to penetrate the cavity of b-cyclodextrin (b-CD) or 1, but it is located between the two secondary rims of 2. The complexes' stability constants (K(s)) from 19 to 37 degrees C, Gibbs free energy changes (DG degrees ), DH degrees and TDS degrees for 1:1 complexes of b-CD, 1 and 2 with ligand 3 as obtained from UV-Vis spectra were compared. The binding of 3 by the three cyclodextrin hosts generally decreased in the order of 1>2>b-CD. The binding ability of 3 by b-CD, 1 and 2 was discussed with regard to the size/shape-fit concept, the induced-fit interaction, and the cooperative interaction of the dual hydrophobic cavities. The binding ability of 1>2indicated that the length of linkage between two cyclodextrin units plays a crucial role in the interaction with 3.

Two-dimensional infrared spectroscopy and principal component analysis studies on a new azobenzene derivative supramolecular system based on hydrogen bonds.

Infrared (IR) spectra of a supramolecular assembly with an azobenzene derivative and intermolecular hydrogen bonds have been measured in the temperature range from 30 to 200 degrees C to investigate heat-induced structural changes and thermal stability. Principal component analysis (PCA) and two kinds of two-dimensional (2D) correlation spectroscopy, variable-variable (VV) 2D and sample-sample (SS) 2D spectroscopy, have been employed to analyze the observed temperature-dependent spectral variations. The PCA and SS 2D correlation analyses have demonstrated that the complete decoupling of hydrogen bonds in the supramolecular assembly occurs between 110 and 115 degrees C, which is in good agreement with the results of a differential scanning calorimetry (DSC) study for the heating process. The PCA of the IR spectra in the region of 3600-3100 cm(-1) has illustrated that there are at least four principal components for the different NH2 and CONH species in the present supramolecular system. The VV 2D correlation spectroscopy study has provided information about the structure and strength of hydrogen bonds of NH2 and CONH groups and their temperature-dependent variations. The different species of hydrogen-bonded NH2 and CONH groups in the supramolecular system can be clarified by the VV 2D correlation analysis. The VV 2D correlation analysis has also revealed the specific order of the temperature-induced changes in the hydrogen bonds of NH2 and CONH groups.