001     188458
005     20240619091131.0
024 7 _ |a 10.1107/S2053230X14004087
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037 _ _ |a FZJ-2015-01834
082 _ _ |a 530
100 1 _ |a Yokoyama, Takeshi
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|e Corresponding Author
245 _ _ |a Crystallization and preliminary neutron diffraction experiment of human farnesyl pyrophosphate synthase complexed with risedronate
260 _ _ |a Oxford [u.a.]
|c 2014
|b Blackwell
336 7 _ |a Journal Article
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336 7 _ |a article
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520 _ _ |a Nitrogen-containing bisphosphonates (N-BPs), such as risedronate and zoledronate, are currently used as a clinical drug for bone-resorption diseases and are potent inhibitors of farnesyl pyrophosphate synthase (FPPS). X-ray crystallographic analyses of FPPS with N-BPs have revealed that N-BPs bind to FPPS with three magnesium ions and several water molecules. To understand the structural characteristics of N-BPs bound to FPPS, including H atoms and hydration by water, neutron diffraction studies were initiated using BIODIFF at the Heinz Maier-Leibnitz Zentrum (MLZ). FPPS-risedronate complex crystals of approximate dimensions 2.8 × 2.5 × 1.5 mm (~3.5 mm3) were obtained by repeated macro-seeding. Monochromatic neutron diffraction data were collected to 2.4 Å resolution with 98.4% overall completeness. Here, the first successful neutron data collection from FPPS in complex with N-BPs is reported.
536 _ _ |a 54G - JCNS (POF2-54G24)
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693 _ _ |a Forschungs-Neutronenquelle Heinz Maier-Leibnitz
|e BIODIFF: Diffractometer for large unit cells
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700 1 _ |a Ostermann, Andreas
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700 1 _ |a Mizuguchi, Mineyuki
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700 1 _ |a Niimura, Nobuo
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700 1 _ |a Schrader, Tobias E.
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700 1 _ |a Tanaka, Ichiro
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773 _ _ |a 10.1107/S2053230X14004087
|0 PERI:(DE-600)2175956-X
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|t Acta crystallographica / F
|v 70
|y 2014
|x 1744-3091
909 C O |o oai:juser.fz-juelich.de:188458
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910 1 _ |a Forschungszentrum Jülich GmbH
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914 1 _ |y 2014
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