Experiments C02 /OGO 2/ and D02 /OGO 4/ Final report, 2 Nov. 1962 - 31 Jul. 1969

VLF data from OGO 2 and OGO 4 on propagation, wave-particle interactions, and noise in ionosphere and magnetospher

Carboplatin binding to a model protein in non-NaCl conditions to eliminate partial conversion to cisplatin, and the use of different criteria to choose the resolution limit

Hen egg white lysozyme (HEWL) co-crystallisation conditions of carboplatin without sodium chloride (NaCl) have been utilised to eliminate partial conversion of carboplatin to cisplatin observed previously. Tetragonal HEWL crystals were successfully obtained in 65% MPD with 0.1M citric acid buffer at pH 4.0 including DMSO. The X-ray diffraction data resolution to be used for the model refinement was reviewed using several topical criteria together. The CC1/2 criterion implemented in XDS led to data being significant to 2.0{\AA}, compared to the data only being able to be processed to 3.0{\AA} using the Bruker software package (SAINT). Then using paired protein model refinements and DPI values based on the FreeR value, the resolution limit was fine tuned to be 2.3{\AA}. Interestingly this was compared with results from the EVAL software package which gave a resolution limit of 2.2{\AA} solely using crossing 2, but 2.8{\AA} based on the Rmerge values (60%). The structural results showed that carboplatin bound to only the N{\delta} binding site of His-15 one week after crystal growth, whereas five weeks after crystal growth, two molecules of carboplatin are bound to the His-15 residue. In summary several new results have emerged: - firstly non-NaCl conditions showed a carboplatin molecule bound to His-15 of HEWL; secondly binding of one molecule of carboplatin was seen after one week of crystal growth and two molecules were bound after five weeks of crystal growth; and thirdly the use of several criteria to determine the diffraction resolution limit led to the successful use of data to higher resolution.Comment: 14 pages; submitted to Acta Cryst D Biological Crystallography reference number tz504

Land use influences on acidification and recovery of freshwaters in Galloway, south-west Scotland

International audienceThe long term response of surface waters to changes in sulphur deposition and afforestation is investigated for three upland river systems in the Galloway region of south-west Scotland. From 1984-1999, these rivers exhibited a statistically significant decline in non-marine sulphate concentrations in response to reduced acid deposition. This reduction in non-marine sulphate was, however, insufficient to induce a pH recovery over the period. A statistically significant increase in river pH was observed between 1956-1970 (0.05 yr-1) when subsidised agricultural lime payments were at a maximum. In 1976, this subsidy ceased and surface waters have progressively acidified. In addition, climatic change is found to influence long-term trends in pH. Mean annual pH was greatest during a dry period between 1969-1973 when total annual discharge was low. Thereafter, pH declined gradually in response to higher rainfall and increased total annual discharge. Overall, surface waters draining the afforested catchments of the Rivers Cree and Bladnoch are more acid than those draining the moorland catchment of the Luce. These results indicate that in afforested catchments, current reductions in sulphur emissions have not led to an observed improvement in the acid status of surface waters. Forestry, therefore, represents a confounding factor with regard to chemical recovery from acidification in this region. Keywords: acidification, afforestation, deposition, rivers, lochs, non-marine sulphate, p

Crystallographic MAD Phasing Strategies Explored Using ELETTRA Sincrotrone Mn K-Edge Data to 2.1 Å and Use of CHESS Establishes the Diffraction Resolution Limit as 0.92 Å for the Protein Mn, Ca Concanavalin A

Multiwavelength anomalous dispersion (MAD) data have been collected from a single crystal of the protein concanavalin A so as to evaluate different combinations of wavelengths for crystallographic structure determination. Data were recorded to 2.1 Å resolution on a flash frozen crystal at three wavelengths about the Mn K-edge (1.8951 Å, 1.8940 Å, 1.800 Å) using synchrotron radiation at ELETTRA\u27s Sincrotrone Trieste \u27XRD\u27 beamline. This is one of the longest wavelength K-edge MAD studies undertaken to date. Anomalous and dispersive Patterson maps are seen to be of high quality and indicate a high occupancy for the manganese binding site. This is confirmed also in the MAD phase determination and electron density maps. Finally 0.92 Å data recorded at CHESS indicates the prospects available for combined phasing strategies based on MAD to medium/high resolution along with ultra high resolution data

Extensive counter-ion interactions seen at the surface of subtilisin in an aqueous medium

The extent of protein and counter-ion interactions in solution is still far from being fully described and understood. In low dielectric media there is documented evidence that counter-ions do bind and affect enzymatic activity. However, published crystal structures of macromolecules of biological interest in aqueous solution often do not report the presence of any counter-ions on the surface. The extent of counter-ion interactions within subtilisin in an aqueous medium has been investigated crystallographically using CsCl soak and X-ray wavelength optimised anomalous diffraction at the Cs K-edge. Ten Cs+, as well as six Cl- sites, have been clearly identified, revealing that in aqueous salt solutions ions can bind at defined points around the protein surface. The counter-ions do not generally interact with formal charges on the protein; formally neutral oxygens, mostly backbone carbonyls, mostly coordinate the Cs+ ions. The Cl- ion sites are also found likely to be near positive charges on the protein surface. The presence of counter-ions substantially changes the protein surface electrical charge. The surface charge distribution on a protein is commonly discussed in relation to enzyme function. The correct identification of counter-ions associated with a protein surface is necessary for a proper understanding of an enzyme's function

Recovery from acidification of lochs in Galloway, south-west Scotland, UK: 1979-1998

International audienceThe Galloway region of south-west Scotland has historically been subject to long-term deposition of acidic precipitation which has resulted in acidification of soils and surface waters and subsequent damage to aquatic ecology. Since the end of the 1970s, however, acidic deposition has decreased substantially. The general pattern is for a rapid decline in non-marine sulphate in rainwater over the period 1978-1988 followed by stable concentrations to the mid-1990s. Concentrations of nitrate and ammonium in deposition have remained constant between 1980 and 1998. Seven water quality surveys of 48 lochs in the Galloway region have been conducted between 1979 and 1998. During the first 10 years, from 1979, there was a major decline in regional sulphate concentrations in the lochs, which was expected to have produced a decline in base cations and an increase in the acid neutralising capacity. But sea-salt levels (as indicated by chloride concentrations) were approximately 25% higher in 1988 than in 1979 and thus short-term acidification due to sea-salts offset much of the long-term recovery trend expected in the lochs. During the next 10 years, however, the chloride concentrations returned to 1979 levels and the lochs showed large increases in acid neutralising capacity despite little change in sulphate concentrations. From the observed decline in sulphate deposition and concentrations of sulphate in the lochs, it appears that approximately 75% of the possible improvement in acid neutralising capacity has already occurred over the 20-year period (1979-1998). The role of acid deposition as a driving factor for change in water chemistry in the Galloway lochs is confounded by concurrent changes in other driving variables, most notably, factors related to episodic and year-to-year variations in climate. In addition to inputs of sea-salts, climate probably also influences other chemical signals such as peaks in regional nitrate concentrations and the sharp increase in dissolved organic carbon during the 1990s. Keywords: acidification, recovery, Galloway, sulphur, nitroge

Quantum singularity of Levi-Civita spacetimes

Quantum singularities in general relativistic spacetimes are determined by the behavior of quantum test particles. A static spacetime is quantum mechanically singular if the spatial portion of the wave operator is not essentially self-adjoint. Here Weyl's limit point-limit circle criterion is used to determine whether a wave operator is essentially self-adjoint. This test is then applied to scalar wave packets in Levi-Civita spacetimes to help elucidate the physical properties of the spacetimes in terms of their metric parameters

Classical and quantum properties of a 2-sphere singularity

Recently Boehmer and Lobo have shown that a metric due to Florides, which has been used as an interior Schwarzschild solution, can be extended to reveal a classical singularity that has the form of a two-sphere. Here the singularity is shown to be a scalar curvature singularity that is both timelike and gravitationally weak. It is also shown to be a quantum singularity because the Klein-Gordon operator associated with quantum mechanical particles approaching the singularity is not essentially self-adjoint.Comment: 10 pages, 1 figure, minor corrections, final versio