1XQN
 
 | | The 15k neutron structure of saccharide-free concanavalin A | | 分子名称: | CALCIUM ION, Concanavalin A, MANGANESE (II) ION | | 著者 | Blakeley, M.P, Kalb-Gilboa, A.J, Helliwell, J.R, Myles, D.A.A. | | 登録日 | 2004-10-13 | | 公開日 | 2004-11-02 | | 最終更新日 | 2024-04-03 | | 実験手法 | NEUTRON DIFFRACTION (2.5 Å) | | 主引用文献 | The 15-K neutron structure of saccharide-free concanavalin A
Proc.Natl.Acad.Sci.Usa, 101, 2004
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5AKR
 | | ATOMIC RESOLUTION STRUCTURE OF NITRITE BOUND STATE OF THE ACHROMOBACTER CYCLOCLASTES CU NITRITE REDUCTASE AT 0.87 A RESOLUTION | | 分子名称: | ACETATE ION, COPPER (II) ION, COPPER-CONTAINING NITRITE REDUCTASE, ... | | 著者 | Blakeley, M.P, Hasnain, S.S, Antonyuk, S.V. | | 登録日 | 2015-03-05 | | 公開日 | 2015-07-08 | | 最終更新日 | 2024-01-10 | | 実験手法 | X-RAY DIFFRACTION (0.87 Å) | | 主引用文献 | Sub-Atomic Resolution X-Ray Crystallography and Neutron Crystallography: Promise, Challenges and Potential.
Iucrj, 2, 2015
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2QXW
 | | Perdeuterated alr2 in complex with idd594 | | 分子名称: | Aldose reductase, CITRIC ACID, IDD594, ... | | 著者 | Blakeley, M.P, Ruiz, F, Cachau, R, Hazemann, I, Meilleur, F, Mitschler, A, Ginell, S, Afonine, P, Ventura, O, Cousido-Siah, A, Joachimiak, A, Myles, D, Podjarny, A. | | 登録日 | 2007-08-13 | | 公開日 | 2008-01-22 | | 最終更新日 | 2023-08-30 | | 実験手法 | X-RAY DIFFRACTION (0.8 Å) | | 主引用文献 | Quantum model of catalysis based on a mobile proton revealed by subatomic x-ray and neutron diffraction studies of h-aldose reductase.
Proc.Natl.Acad.Sci.Usa, 105, 2008
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2R24
 | | Human Aldose Reductase structure | | 分子名称: | Aldose reductase, IDD594, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE | | 著者 | Blakeley, M.P, Ruiz, F, Cachau, R, Hazemann, I, Meilleur, F, Mitschler, A, Ginell, S, Afonine, P, Ventura, O.N, Cousido-Siah, A, Haertlein, M, Joachimiak, A, Myles, D, Podjarny, A. | | 登録日 | 2007-08-24 | | 公開日 | 2008-12-23 | | 最終更新日 | 2024-02-21 | | 実験手法 | NEUTRON DIFFRACTION (1.752 Å), X-RAY DIFFRACTION | | 主引用文献 | Quantum model of catalysis based on mobile proton revealed by subatomic X-Ray and neutron diffraction studies of h-Aldose Reductase
Proc.Natl.Acad.Sci.USA, 105, 2008
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3R99
 | | Joint Neutron and X-ray structure of Cytochrome c peroxidase | | 分子名称: | Cytochrome c peroxidase, PROTOPORPHYRIN IX CONTAINING FE | | 著者 | Blakeley, M.P, Fisher, S.J, Gumiero, A, Moody, P.C.E, Raven, E.L. | | 登録日 | 2011-03-25 | | 公開日 | 2012-04-04 | | 最終更新日 | 2024-03-20 | | 実験手法 | NEUTRON DIFFRACTION (2.4 Å), X-RAY DIFFRACTION | | 主引用文献 | Hydrogen bonds in heme peroxidases: a combined X-ray and neutron study of cytochrome c peroxidase
To be Published
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3R98
 | | Joint Neutron and X-ray structure of Cytochrome c peroxidase | | 分子名称: | Cytochrome c peroxidase, PROTOPORPHYRIN IX CONTAINING FE | | 著者 | Blakeley, M.P, Fisher, S.J, Gumiero, A, Moody, P.C.E, Raven, E.L. | | 登録日 | 2011-03-25 | | 公開日 | 2012-04-04 | | 最終更新日 | 2024-03-20 | | 実験手法 | NEUTRON DIFFRACTION (2.4 Å), X-RAY DIFFRACTION | | 主引用文献 | Hydrogen bonds in heme peroxidases: a combined X-ray and neutron study of cytochrome c peroxidase
To be Published
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4YTA
 | | BOND LENGTH ANALYSIS OF ASP, GLU AND HIS RESIDUES IN TRYPSIN AT 1.2A RESOLUTION | | 分子名称: | BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... | | 著者 | Fisher, S.J, Helliwell, J.R, Blakeley, M.P, Cianci, M, McSweeny, S. | | 登録日 | 2015-03-17 | | 公開日 | 2015-05-27 | | 最終更新日 | 2024-02-07 | | 実験手法 | X-RAY DIFFRACTION (1.2 Å) | | 主引用文献 | Protonation-state determination in proteins using high-resolution X-ray crystallography: effects of resolution and completeness.
Acta Crystallogr. D Biol. Crystallogr., 68, 2012
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5NFE
 | | Neutron structure of human transthyretin (TTR) T119M mutant at room temperature to 1.85A resolution | | 分子名称: | Transthyretin | | 著者 | Yee, A.W, Moulin, M, Blakeley, M.P, Ostermann, A, Cooper, J.B, Haertlein, M, Mitchell, E.P, Forsyth, V.T. | | 登録日 | 2017-03-14 | | 公開日 | 2019-01-02 | | 最終更新日 | 2024-05-01 | | 実験手法 | NEUTRON DIFFRACTION (1.853 Å), X-RAY DIFFRACTION | | 主引用文献 | A molecular mechanism for transthyretin amyloidogenesis.
Nat Commun, 10, 2019
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6XV4
 | | Neutron structure of ferric ascorbate peroxidase-ascorbate complex | | 分子名称: | ASCORBIC ACID, Ascorbate peroxidase, POTASSIUM ION, ... | | 著者 | Kwon, H, Basran, J, Devos, J.M, Schrader, T.E, Ostermann, A, Blakeley, M.P, Raven, E.L, Moody, P.C.E. | | 登録日 | 2020-01-21 | | 公開日 | 2020-03-18 | | 最終更新日 | 2024-05-01 | | 実験手法 | NEUTRON DIFFRACTION (1.9 Å), X-RAY DIFFRACTION | | 主引用文献 | Visualizing the protons in a metalloenzyme electron proton transfer pathway.
Proc.Natl.Acad.Sci.USA, 117, 2020
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5NFW
 | | Neutron structure of human transthyretin (TTR) S52P mutant at room temperature to 1.8A resolution (quasi-Laue) | | 分子名称: | Transthyretin | | 著者 | Yee, A.W, Moulin, M, Blakeley, M.P, Cooper, J.B, Haertlein, M, Mitchell, E.P, Forsyth, V.T. | | 登録日 | 2017-03-16 | | 公開日 | 2019-01-02 | | 最終更新日 | 2024-05-01 | | 実験手法 | NEUTRON DIFFRACTION (1.8 Å), X-RAY DIFFRACTION | | 主引用文献 | A molecular mechanism for transthyretin amyloidogenesis.
Nat Commun, 10, 2019
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6TAE
 | | Neutron structure of ferric ascorbate peroxidase | | 分子名称: | Ascorbate peroxidase, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION | | 著者 | Kwon, H, Basran, J, Devos, J.M, Schrader, T.E, Ostermann, A, Blakeley, M.P, Raven, E.L, Moody, P.C.E. | | 登録日 | 2019-10-29 | | 公開日 | 2020-03-18 | | 最終更新日 | 2024-05-01 | | 実験手法 | NEUTRON DIFFRACTION (1.9 Å), X-RAY DIFFRACTION | | 主引用文献 | Visualizing the protons in a metalloenzyme electron proton transfer pathway.
Proc.Natl.Acad.Sci.USA, 117, 2020
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5JPR
 | | Neutron Structure of Compound II of Ascorbate Peroxidase | | 分子名称: | Ascorbate peroxidase, POTASSIUM ION, PROTOPORPHYRIN IX CONTAINING FE, ... | | 著者 | Kwon, H, Blakeley, M.P, Raven, E.L, Moody, P.C.E. | | 登録日 | 2016-05-04 | | 公開日 | 2016-12-21 | | 最終更新日 | 2024-05-01 | | 実験手法 | NEUTRON DIFFRACTION (1.806 Å), X-RAY DIFFRACTION | | 主引用文献 | Direct visualization of a Fe(IV)-OH intermediate in a heme enzyme.
Nat Commun, 7, 2016
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5CE4
 | | High Resolution X-Ray and Neutron diffraction structure of H-FABP | | 分子名称: | Fatty acid-binding protein, heart, OLEIC ACID | | 著者 | Podjarny, A.D, Howard, E.I, Blakeley, M.P, Guillot, B. | | 登録日 | 2015-07-06 | | 公開日 | 2016-03-09 | | 最終更新日 | 2024-05-08 | | 実験手法 | NEUTRON DIFFRACTION (0.98 Å), X-RAY DIFFRACTION | | 主引用文献 | High-resolution neutron and X-ray diffraction room-temperature studies of an H-FABP-oleic acid complex: study of the internal water cluster and ligand binding by a transferred multipolar electron-density distribution.
Iucrj, 3, 2016
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8EYP
 | | Joint X-ray/neutron structure of Salmonella typhimurium tryptophan synthase internal aldimine from microgravity-grown crystal | | 分子名称: | SODIUM ION, Tryptophan synthase alpha chain, Tryptophan synthase beta chain | | 著者 | Drago, V.N, Kovalevsky, A, Blakeley, M.P, Forsyth, V.T, Mueser, T.C. | | 登録日 | 2022-10-28 | | 公開日 | 2024-02-14 | | 最終更新日 | 2024-05-08 | | 実験手法 | NEUTRON DIFFRACTION (1.8 Å), X-RAY DIFFRACTION | | 主引用文献 | Neutron diffraction from a microgravity-grown crystal reveals the active site hydrogens of the internal aldimine form of tryptophan synthase.
Cell Rep Phys Sci, 5, 2024
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7O60
 | | Crystal structure of human myelin protein P2 at room temperature from joint X-ray and neutron refinement. | | 分子名称: | CITRIC ACID, Myelin P2 protein, PALMITIC ACID | | 著者 | Laulumaa, S, Blakeley, M.P, Kursula, P. | | 登録日 | 2021-04-09 | | 公開日 | 2021-09-01 | | 最終更新日 | 2024-05-01 | | 実験手法 | NEUTRON DIFFRACTION (2 Å), X-RAY DIFFRACTION | | 主引用文献 | Human myelin protein P2: from crystallography to time-lapse membrane imaging and neuropathy-associated variants.
Febs J., 288, 2021
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2YZ4
 | | The neutron structure of concanavalin A at 2.2 Angstroms | | 分子名称: | CALCIUM ION, Concanavalin A, MANGANESE (II) ION | | 著者 | Ahmed, H.U, Blakeley, M.P, Cianci, M, Hubbard, J.A, Helliwell, J.R. | | 登録日 | 2007-05-02 | | 公開日 | 2008-02-05 | | 最終更新日 | 2023-10-25 | | 実験手法 | NEUTRON DIFFRACTION (2.2 Å) | | 主引用文献 | The determination of protonation states in proteins.
Acta Crystallogr.,Sect.D, 63, 2007
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2XQZ
 | | Neutron structure of the perdeuterated Toho-1 R274N R276N double mutant beta-lactamase | | 分子名称: | BETA-LACTAMSE TOHO-1 | | 著者 | Tomanicek, S.J, Wang, K.K, Weiss, K.L, Blakeley, M.P, Cooper, J, Chen, Y, Coates, L. | | 登録日 | 2010-09-08 | | 公開日 | 2010-12-22 | | 最終更新日 | 2024-05-08 | | 実験手法 | NEUTRON DIFFRACTION (2.1 Å) | | 主引用文献 | The Active Site Protonation States of Perdeuterated Toho-1 Beta-Lactamase Determined by Neutron Diffraction Support a Role for Glu166 as the General Base in Acylation.
FEBS Lett., 585, 2011
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2XR0
 | | Room temperature X-ray structure of the perdeuterated Toho-1 R274N R276N double mutant beta-lactamase | | 分子名称: | SULFATE ION, TOHO-1 BETA-LACTAMASE | | 著者 | Tomanicek, S.J, Wang, K.K, Weiss, K.L, Blakeley, M.P, Cooper, J, Chen, Y, Coates, L. | | 登録日 | 2010-09-08 | | 公開日 | 2010-12-22 | | 最終更新日 | 2023-12-20 | | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | | 主引用文献 | The Active Site Protonation States of Perdeuterated Toho-1 Beta-Lactamase Determined by Neutron Diffraction Support a Role for Glu166 as the General Base in Acylation.
FEBS Lett., 585, 2011
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4N9M
 | | Joint neutron/x-ray structure of urate oxidase in complex with 8-hydroxyxanthine | | 分子名称: | 8-hydroxy-3,9-dihydro-1H-purine-2,6-dione, CHLORIDE ION, SODIUM ION, ... | | 著者 | Oksanen, E, Blakeley, M.P, Budayova-Spano, M. | | 登録日 | 2013-10-21 | | 公開日 | 2014-02-05 | | 最終更新日 | 2018-06-13 | | 実験手法 | NEUTRON DIFFRACTION (2.023 Å), X-RAY DIFFRACTION | | 主引用文献 | The neutron structure of urate oxidase resolves a long-standing mechanistic conundrum and reveals unexpected changes in protonation.
Plos One, 9, 2014
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4N9V
 | | High resolution x-ray structure of urate oxidase in complex with 8-azaxanthine | | 分子名称: | 8-AZAXANTHINE, CHLORIDE ION, GLYCEROL, ... | | 著者 | Oksanen, E, Blakeley, M.P, Budayova-Spano, M. | | 登録日 | 2013-10-21 | | 公開日 | 2014-02-05 | | 最終更新日 | 2023-09-20 | | 実験手法 | X-RAY DIFFRACTION (1.1 Å) | | 主引用文献 | The neutron structure of urate oxidase resolves a long-standing mechanistic conundrum and reveals unexpected changes in protonation.
Plos One, 9, 2014
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7PRG
 | | Joint X-ray/neutron room temperature structure of perdeuterated LecB lectin in complex with perdeuterated fucose | | 分子名称: | CALCIUM ION, Fucose-binding lectin, SULFATE ION, ... | | 著者 | Gajdos, L, Blakeley, M.P, Haertlein, M, Forsyth, T.V, Devos, J.M, Imberty, A. | | 登録日 | 2021-09-21 | | 公開日 | 2022-01-12 | | 最終更新日 | 2024-05-01 | | 実験手法 | NEUTRON DIFFRACTION (1.85 Å), X-RAY DIFFRACTION | | 主引用文献 | Neutron crystallography reveals mechanisms used by Pseudomonas aeruginosa for host-cell binding.
Nat Commun, 13, 2022
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7PSY
 | | X-ray crystal structure of perdeuterated LecB lectin in complex with perdeuterated fucose | | 分子名称: | CALCIUM ION, Fucose-binding lectin, SULFATE ION, ... | | 著者 | Gajdos, L, Blakeley, M.P, Haertlein, M, Forsyth, T.V, Devos, J.M, Imberty, A. | | 登録日 | 2021-09-24 | | 公開日 | 2022-01-12 | | 最終更新日 | 2024-01-31 | | 実験手法 | X-RAY DIFFRACTION (0.9 Å) | | 主引用文献 | Neutron crystallography reveals mechanisms used by Pseudomonas aeruginosa for host-cell binding.
Nat Commun, 13, 2022
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4AR6
 | | X-ray crystallographic structure of the reduced form perdeuterated Pyrococcus furiosus rubredoxin at 295 K (in quartz capillary) to 0.92 Angstroms resolution. | | 分子名称: | FE (III) ION, RUBREDOXIN | | 著者 | Cuypers, M.G, Mason, S.A, Blakeley, M.P, Mitchell, E.P, Haertlein, M, Forsyth, V.T. | | 登録日 | 2012-04-20 | | 公開日 | 2012-12-19 | | 最終更新日 | 2024-05-08 | | 実験手法 | X-RAY DIFFRACTION (0.92 Å) | | 主引用文献 | Near-Atomic Resolution Neutron Crystallography on Perdeuterated Pyrococcus Furiosus Rubredoxin: Implication of Hydronium Ions and Protonation Equilibria and Hydronium Ions in Redox Changes
Angew.Chem.Int.Ed.Engl., 52, 2013
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3UNX
 | | Bond length analysis of asp, glu and his residues in subtilisin Carlsberg at 1.26A resolution | | 分子名称: | CALCIUM ION, GLYCEROL, SODIUM ION, ... | | 著者 | Fisher, S.J, Helliwell, J.R, Blakeley, M.P, Cianci, M, McSweeny, S. | | 登録日 | 2011-11-16 | | 公開日 | 2012-06-27 | | 最終更新日 | 2023-09-13 | | 実験手法 | X-RAY DIFFRACTION (1.26 Å) | | 主引用文献 | Protonation-state determination in proteins using high-resolution X-ray crystallography: effects of resolution and completeness.
Acta Crystallogr.,Sect.D, 68, 2012
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4AR4
 | | Neutron crystallographic structure of the reduced form perdeuterated Pyrococcus furiosus rubredoxin to 1.38 Angstrom resolution. | | 分子名称: | FE (III) ION, Rubredoxin, deuterium(1+), ... | | 著者 | Cuypers, M.G, Mason, S.A, Blakeley, M.P, Mitchell, E.P, Haertlein, M, Forsyth, V.T. | | 登録日 | 2012-04-20 | | 公開日 | 2013-01-16 | | 最終更新日 | 2024-06-19 | | 実験手法 | NEUTRON DIFFRACTION (1.381 Å) | | 主引用文献 | Near-Atomic Resolution Neutron Crystallography on Perdeuterated Pyrococcus Furiosus Rubredoxin: Implication of Hydronium Ions and Protonation State Equilibria in Redox Changes.
Angew.Chem.Int.Ed.Engl., 52, 2013
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