Solid state NMR techniques for the analyses of unlabeled solid samples

• Project/Area Number: 25410158
• Research Category: Grant-in-Aid for Scientific Research (C)
• Allocation Type: Multi-year Fund
• Section: 一般
• Research Field: Analytical chemistry
• Research Institution: Institute for Molecular Science
• Principal Investigator: NISHIMURA Katsuyuki 分子科学研究所, 物質分子科学研究領域, 准教授 (00334631)
• Project Period (FY): 2013-04-01 – 2016-03-31
• Project Status: Completed (Fiscal Year 2015)
• Budget Amount: ¥5,070,000 (Direct Cost: ¥3,900,000、Indirect Cost: ¥1,170,000); Fiscal Year 2015: ¥780,000 (Direct Cost: ¥600,000、Indirect Cost: ¥180,000); Fiscal Year 2014: ¥1,430,000 (Direct Cost: ¥1,100,000、Indirect Cost: ¥330,000); Fiscal Year 2013: ¥2,860,000 (Direct Cost: ¥2,200,000、Indirect Cost: ¥660,000)
• Keywords: 固体NMR / 測定法 / 開発 / 安定同位体 / 天然存在比

Outline of Final Research Achievements

In this study, methodology developments for solid state nuclear magnetic resonance to obtain molecular information precisely through the observation of naturally abudant isotopes in inteact samples have been explored. Those approaches have been successfully applied to various samples to achieve signal assigments and structural characterizations.

Research Products

• [Journal Article] Molecular and electron-spin structures of a ring-shaped mixed-valence polyoxovanadate (IV, V) studied by 11B and 23Na solid-state NMR spectroscopy and DFT calculations (2016)
  • Author(s): Takahiro Iijima, Toshihiro Yamase, Katsuyuki Nishimura
  • Journal Title: Solid State Nuclear Magnetic Resonance Volume: 76-77 Pages: 15-23
  • DOI: 10.1016/j.ssnmr.2016.03.004
  • Peer Reviewed
• [Journal Article] Membrane-Induced Dichotomous Conformation of Amyloid β with the Disordered N-Terminal Segment Followed by the Stable C-Terminal β Structure. (2016)
  • Author(s): Yagi-Utsumi M, Kato K, Nishimura K.
  • Journal Title: PLoS One Volume: 11 Issue: 1 Pages: e0146405-e0146405
  • DOI: 10.1371/journal.pone.0146405
  • Peer Reviewed / Open Access / Acknowledgement Compliant
• [Journal Article] Acid/Base-Regulated Reversible Electron Transfer Disproportionation of N-N linked Bicarbazole and Biacridine Derivatives (2015)
  • Author(s): Palash Pandit,† Koji Yamamoto,† (†: equally contributed) Toshikazu Nakamura, Katsuyuki Nishimura, Yuki Kurashige, Takeshi Yanai, Go Nakamura, Shigeyuki Masaoka, Ko Furukawa, Yumi Yakiyama, Masaki Kawano and Shuhei Higashibayashi
  • Journal Title: Chemical Science Volume: 印刷中 Issue: 7 Pages: 4160-4173
  • DOI: 10.1039/c5sc00946d
  • Peer Reviewed / Open Access / Acknowledgement Compliant
• [Journal Article] Formal Aryne/Carbon Monoxide Copolymerization To Form Aromatic Polyketones/Polyketals (2015)
  • Author(s): Shingo Ito, Wenhan Wang, Katsuyuki Nishimura, and Kyoko Nozaki
  • Journal Title: Macromolecules Volume: 48 Issue: 7 Pages: 1959-1962
  • DOI: 10.1021/acs.macromol.5b00315
  • Peer Reviewed
• [Journal Article] 2H NMR pure-quadrupole spectra for paramagnetic solids (2015)
  • Author(s): Takahiro Iijima, Tadashi Shimizu, Katsuyuki Nishimura
  • Journal Title: J. Magn. Reson. Volume: 251 Pages: 57-64
  • DOI: 10.1016/j.jmr.2014.11.007
  • Peer Reviewed / Acknowledgement Compliant
• [Journal Article] Intermolecular Packing in B. mori Silk Fibroin: Multinuclear NMR Study of the Model Peptide (Ala-Gly)15 Defines a Heterogeneous Antiparallel Antipolar Mode of Assembly in the Silk II Form (2015)
  • Author(s): Asakura, T., Ohata, T., Kametani S., Okushita, K., Yazawa, K., Nishiyama, Y., Nishimura, K., Aoki, A., Suzuki, F., Kaji, H., Anne S. Ulrich, and Mike P. Williamson
  • Journal Title: Macromolecules Volume: 48 Issue: 1 Pages: 28-36
  • DOI: 10.1021/ma502191g
  • Peer Reviewed / Acknowledgement Compliant
• [Journal Article] Electron Localization of Polyoxomolybdates with ε-Keggin Structure Studied by Solid-State 95Mo NMR and DFT Calculation (2014)
  • Author(s): Takahiro Iijima, Toshihiro Yamase, Masataka Tansho, Tadashi Shimizu, Katsuyuki Nishimura
  • Journal Title: J. Phys. Chem. A Volume: 118 Issue: 13 Pages: 2431-2441
  • DOI: 10.1021/jp409969g
  • Peer Reviewed
• [Journal Article] Difference in the structures of alanine tri- and tetra-peptides with antiparallel β-sheet assessed by X-ray diffraction, solid-state NMR and chemical shift calculations by GIPAW (2013)
  • Author(s): T. Asakura, K. Yazawa, K. Horiguchi, F. Suzuki, Y. Nishiyama, K. Nishimura, H. Kaji
  • Journal Title: Biopolymers Volume: 101 Issue: 1 Pages: 13-20
  • DOI: 10.1002/bip.22241
  • Peer Reviewed
• [Journal Article] Determination of Accurate 1H Positions of (Ala-Gly)n as a Sequential Peptide Model of Bombyx mori Silk Fibroin before Spinning (SilkI) (2013)
  • Author(s): Asakura, T.; Suzuki, Y.; Yazawa, K.; Aoki, A.; Nishiyama, Y.; Nishimura, K.; Suzuki, F.; Kaji, H.
  • Journal Title: Macromolecules Volume: 46 Issue: 19 Pages: 8046-8050
  • DOI: 10.1021/ma401531m
  • Peer Reviewed
• [Journal Article] Intramolecular allosteric interaction in the phospholipase C-δ1 pleckstrin homology domain (2013)
  • Author(s): M.Tanio, K.Nishimura
  • Journal Title: Biochim. Biophys. Acta Volume: 1834 Issue: 6 Pages: 1034-1043
  • DOI: 10.1016/j.bbapap.2013.01.034
  • Peer Reviewed
• [Presentation] NMR characterization of conformational transition of amyloid β-peptide promoted on ganglipside clusters (2015)
  • Author(s): Maho Yagi-Utsumi, Katsuyuki Nishimura, Koichi Kato
  • Organizer: The 2015 international Chemical Congress of Pacific Basin Societies
  • Place of Presentation: Honolulu USA
  • Year and Date: 2015-12-15
  • Int'l Joint Research / Invited
• [Presentation] 酸応答性ビカルバゾール誘導体 (2015)
  • Author(s): パンディットパラッシュ、山本浩司、中村敏和、西村勝之、倉重佑輝、柳井毅、中村豪、正岡重行、古川貢 、東林修平
  • Organizer: 日本化学会 第95春季年会
  • Place of Presentation: 千葉県船橋市日本大学理工学部船橋キャンパス／薬学部
  • Year and Date: 2015-03-26 – 2015-03-29
• [Presentation] 固体NMR 及び量子化学計算によるリング状ポリ酸の分子及び電子スピンの構造解析 (2015)
  • Author(s): 飯島隆広、山瀬利博、西村勝之
  • Organizer: 日本化学会 第95春季年会
  • Place of Presentation: 千葉県船橋市日本大学理工学部船橋キャンパス／薬学部
  • Year and Date: 2015-03-26 – 2015-03-29
• [Presentation] 超高速1H MAS NMRによる置換ポリアセチレンの固体構造の研究 (2014)
  • Author(s): 平沖 敏文、小林 哲雄、矢澤 宏次、西山 裕介、朝倉 哲郎、西村 勝之、吉田 嘉晃、馬渡 康輝、田畑 昌祥
  • Organizer: 第５３回ＮＭＲ討論会
  • Place of Presentation: 大阪府吹田市大阪大学コンベンションセンター
  • Year and Date: 2014-11-04 – 2014-11-06
• [Presentation] 超高速1H MAS 固体高分解能NMRによる置換ポリアセチレンの固体構造の研究 (2014)
  • Author(s): 平沖 敏文、小林 哲雄、矢澤宏次、西山 裕介、朝倉 哲郎、西村 勝之、吉田 嘉晃、馬渡 康輝、田畑 昌祥
  • Organizer: 第６３回高分子討論会
  • Place of Presentation: 長崎県長崎市長崎大学文教キャンパス
  • Year and Date: 2014-09-24 – 2014-09-26
• [Presentation] 高分解能1H固体NMRを用いた絹モデル化合物の構造解析 (2014)
  • Author(s): 新井 裕喜、大畑 卓也、瀧口 亮太、鈴木 悠、西村 勝之、朝倉 哲郎
  • Organizer: 第63回高分子学会年次大会
  • Place of Presentation: 愛知県名古屋市名古屋国際会議場
  • Year and Date: 2014-05-28 – 2014-05-30
• [Presentation] 超高速1H MAS NMRのラセン高分子への応用 (2014)
  • Author(s): 平沖 敏文、小林 哲雄、矢澤 宏次、西山 裕介、朝倉 哲郎、西村 勝之
  • Organizer: 第63回高分子学会年次大会
  • Place of Presentation: 愛知県名古屋市名古屋国際会議場
  • Year and Date: 2014-05-28 – 2014-05-30
• [Presentation] 固体95Mo NMRとDFT計算によるε-Kegginポリ酸の電子局在性研究 (2014)
  • Author(s): 飯島隆広, 山瀬利博, 丹所正孝, 丹所正孝, 清水 禎, 西村勝之
  • Organizer: 日本化学会 第94回春季年会
  • Place of Presentation: 名古屋大学 東山キャンパス（愛知県名古屋市）
• [Presentation] Intramolecular allosteric interaction in the phospholipase C-delta1 pleckstrin homology domain (2013)
  • Author(s): M. Tanio, and K. Nishimura
  • Organizer: 第１３回日本蛋白質科学会年会
  • Place of Presentation: とりぎん文化会館（鳥取県鳥取市）
• [Presentation] Intramolecular allostery in the PLC-δ1 PH domain (2013)
  • Author(s): 谷生 道一, 西村 勝之
  • Organizer: 第５１回日本生物物理学会年会
  • Place of Presentation: 国立京都国際会館（京都府京都市）
• [Presentation] PLC-δ1 PHドメインのタンパク質分子内情報伝達 (2013)
  • Author(s): 谷生道一、西村勝之
  • Organizer: 第40回生体分子科学討論会
  • Place of Presentation: 大阪大学吹田キャンパス銀杏会館３階 阪急電鉄・三和銀行ホール（大阪府吹田市）
• [Presentation] NMR analysis of intramolecular allostery in the PLC-δ1 PH domain (2013)
  • Author(s): T. Michikazuand K. Nishimura
  • Organizer: 第 52 回 NMR 討論会
  • Place of Presentation: 石川県立音楽堂（石川県金沢市）
• [Presentation] Probing intermolecular structures of biomolecules in solid state:High resolution 1H solid state NMR analysis under ultra high speed MAS (2013)
  • Author(s): T. Asakura, K. Yazawa,K. Okushita,Y. Suzuki,Y. Nakazawa,A. Aoki, K. Nishimura, Y. Nishiyama, H. Kaji
  • Organizer: 第 52 回 NMR 討論会
  • Place of Presentation: 石川県立音楽堂（石川県金沢市）
• [Presentation] Role of tryptophan residues in membrane association of the SWAP-70 PH domain (2013)
  • Author(s): 赤井 琴乃, 谷生 道一, 西村 勝之, 辻 暁
  • Organizer: 第５１回日本生物物理学会年会
  • Place of Presentation: 国立京都国際会館（京都府京都市）
• [Presentation] 1H solid-state NMR characterization of aqueous grown ZnO nanorods with different growth temperatures (2013)
  • Author(s): K. Ogata, S. Sasa, M. Inoue, M. Yano, and K. Nishimura
  • Organizer: 16th International Conference on II-VI Compound and Related Materials (II-VI 2013)
  • Place of Presentation: Nagahama Royal Hotel（新潟県長浜市）
• [Presentation] 磁性ポリ酸の固体 95 Mo NMR (2013)
  • Author(s): 飯島隆広, 山瀬利博, 丹所正孝, 丹所正孝, 清水 禎, 西村勝之
  • Organizer: 第５３回固体ＮＭＲ･材料フォーラム
  • Place of Presentation: 業技術総合研究所 臨海副都心センター別館 バイオ・IT 研究棟１１F 会議室（東京都江東区）
• [Presentation] 高分解能 1 H固体NMRを用いた生体分子の分子間構造解析 (2013)
  • Author(s): 矢澤 宏次, 大畑 卓也, 西山 裕, 西村 勝之, 朝倉 哲郎
  • Organizer: 第５３回固体ＮＭＲ･材料フォーラム
  • Place of Presentation: 業技術総合研究所 臨海副都心センター別館 バイオ・IT 研究棟１１F 会議室（東京都江東区）