9CGD
 
 | | Human DJ-1, 10 sec mixing with methylglyoxal, pink beam time-resolved serial crystallography, CrystFEL processed | | 分子名称: | Parkinson disease protein 7 | | 著者 | Zielinski, K, Dolamore, C, Dalton, K, Meisburger, S, Smith, N, Termini, J, Henning, R, Srajer, V, Hekstra, D, Pollack, L, Wilson, M.A. | | 登録日 | 2024-06-28 | | 公開日 | 2025-03-12 | | 実験手法 | X-RAY DIFFRACTION (1.97 Å) | | 主引用文献 | Resolving DJ-1 Glyoxalase Catalysis Using Mix-and-Inject Serial Crystallography at a Synchrotron.
Biorxiv, 2024
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9CGE
 | | Human DJ-1, 15 sec mixing with methylglyoxal, pink beam time-resolved serial crystallography, CrystFEL processed | | 分子名称: | Parkinson disease protein 7 | | 著者 | Zielinski, K, Dolamore, C, Dalton, K, Meisburger, S, Smith, N, Termini, J, Henning, R, Srajer, V, Hekstra, D, Pollack, L, Wilson, M.A. | | 登録日 | 2024-06-28 | | 公開日 | 2025-03-12 | | 実験手法 | X-RAY DIFFRACTION (1.9 Å) | | 主引用文献 | Resolving DJ-1 Glyoxalase Catalysis Using Mix-and-Inject Serial Crystallography at a Synchrotron.
Biorxiv, 2024
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7TIF
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9GOK
 | | X-ray structure of lysozyme obtained upon reaction with the dioxidovanadium(V) complex with (E)-N'-(1-(2-hydroxy-5-methoxyphenyl)ethylidene)furan-2-carbohydrazide) | | 分子名称: | ACETATE ION, CHLORIDE ION, Lysozyme C, ... | | 著者 | Paolillo, M, Ferraro, G, Merlino, A. | | 登録日 | 2024-09-05 | | 公開日 | 2024-12-18 | | 実験手法 | X-RAY DIFFRACTION (1.18 Å) | | 主引用文献 | Interaction of V V O 2 -hydrazonates with lysozyme.
J.Inorg.Biochem., 264, 2024
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9CFY
 | | Human DJ-1, 15 sec mixing with methylglyoxal, pink beam time-resolved serial crystallography | | 分子名称: | Parkinson disease protein 7 | | 著者 | Zielinski, K.A, Dolamore, C, Dalton, K, Meisburger, S.P, Smith, N, Termini, T, Henning, R, Srajer, V, Hekstra, D, Pollack, L, Wilson, M.A. | | 登録日 | 2024-06-27 | | 公開日 | 2025-03-12 | | 実験手法 | X-RAY DIFFRACTION (1.77 Å) | | 主引用文献 | Resolving DJ-1 Glyoxalase Catalysis Using Mix-and-Inject Serial Crystallography at a Synchrotron.
Biorxiv, 2024
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9CG0
 | | Human DJ-1, 30 sec mixing with methylglyoxal, pink beam time-resolved serial crystallography | | 分子名称: | Parkinson disease protein 7 | | 著者 | Zielinski, K.A, Dolamore, C, Dalton, K, Meisburger, S.P, Smith, N, Termini, J, Henning, R, Srajer, V, Hekstra, D, Pollack, L, Wilson, M.A. | | 登録日 | 2024-06-28 | | 公開日 | 2025-03-12 | | 実験手法 | X-RAY DIFFRACTION (1.77 Å) | | 主引用文献 | Resolving DJ-1 Glyoxalase Catalysis Using Mix-and-Inject Serial Crystallography at a Synchrotron.
Biorxiv, 2024
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9CGG
 | | Human DJ-1, 30 sec mixing with methylglyoxal, pink beam time-resolved serial crystallography, CrystFEL processed | | 分子名称: | Parkinson disease protein 7 | | 著者 | Zielinski, K, Dolamore, C, Dalton, K, Meisburger, S, Smith, N, Termini, J, Henning, R, Srajer, V, Hekstra, D, Pollack, L, Wilson, M.A. | | 登録日 | 2024-06-28 | | 公開日 | 2025-03-12 | | 実験手法 | X-RAY DIFFRACTION (2.01 Å) | | 主引用文献 | Resolving DJ-1 Glyoxalase Catalysis Using Mix-and-Inject Serial Crystallography at a Synchrotron.
Biorxiv, 2024
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9CEI
 | | Human DJ-1, no mixing, pink beam time-resolved serial crystallography | | 分子名称: | Parkinson disease protein 7 | | 著者 | Zielinski, K.A, Dolamore, C, Dalton, K, Meisburger, S.P, Smith, N, Termini, J, Henning, R, Srajer, V, Hekstra, D, Pollack, L, Wilson, M.A. | | 登録日 | 2024-06-26 | | 公開日 | 2025-03-12 | | 実験手法 | X-RAY DIFFRACTION (1.77 Å) | | 主引用文献 | Resolving DJ-1 Glyoxalase Catalysis Using Mix-and-Inject Serial Crystallography at a Synchrotron.
Biorxiv, 2024
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7BXA
 | | Crystal structure of PD-1 in complex with tislelizumab Fab | | 分子名称: | Programmed cell death protein 1, heavy chain, light chain | | 著者 | Heo, Y.S, Lee, S.H, Lim, H, Lee, H.T, Kim, Y.J, Park, E.B. | | 登録日 | 2020-04-18 | | 公開日 | 2020-06-10 | | 最終更新日 | 2024-11-13 | | 実験手法 | X-RAY DIFFRACTION (3.32 Å) | | 主引用文献 | Crystal structure of PD-1 in complex with an antibody-drug tislelizumab used in tumor immune checkpoint therapy.
Biochem.Biophys.Res.Commun., 527, 2020
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7BTS
 | | Structure of human beta1 adrenergic receptor bound to epinephrine and nanobody 6B9 | | 分子名称: | (2S)-2,3-dihydroxypropyl (7Z)-tetradec-7-enoate, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CHOLESTEROL, ... | | 著者 | Xu, X, Kaindl, J, Clark, M, Hubner, H, Hirata, K, Sunahara, R, Gmeiner, P, Kobilka, B.K, Liu, X. | | 登録日 | 2020-04-02 | | 公開日 | 2020-12-02 | | 最終更新日 | 2024-10-30 | | 実験手法 | X-RAY DIFFRACTION (3.13 Å) | | 主引用文献 | Binding pathway determines norepinephrine selectivity for the human beta 1 AR over beta 2 AR.
Cell Res., 31, 2021
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6B96
 | | Crystal Structure of PDE2 in complex with compound 16 | | 分子名称: | 1,2-ETHANEDIOL, 6-chloro-N-{1-[4-(trifluoromethyl)phenyl]cyclopropyl}-1H-pyrazolo[3,4-d]pyrimidin-4-amine, MAGNESIUM ION, ... | | 著者 | Lu, J. | | 登録日 | 2017-10-10 | | 公開日 | 2017-11-22 | | 最終更新日 | 2024-03-06 | | 実験手法 | X-RAY DIFFRACTION (1.88 Å) | | 主引用文献 | The identification of a novel lead class for phosphodiesterase 2 inhibition by fragment-based drug design.
Bioorg. Med. Chem. Lett., 27, 2017
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9MDT
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9MED
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9MF6
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9CFQ
 | | Human DJ-1, no mixing, pink beam time-resolved serial crystallography, CrystFEL processed | | 分子名称: | Parkinson disease protein 7 | | 著者 | Zielinski, K, Dolamore, C, Dalton, K, Meisburger, S, Smith, N, Termini, J, Henning, R, Srajer, V, Hekstra, D, Pollack, L, Wilson, M.A. | | 登録日 | 2024-06-27 | | 公開日 | 2025-03-12 | | 実験手法 | X-RAY DIFFRACTION (1.9 Å) | | 主引用文献 | Resolving DJ-1 Glyoxalase Catalysis Using Mix-and-Inject Serial Crystallography at a Synchrotron.
Biorxiv, 2024
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9CMX
 | | Human DJ-1, fixed target serial crystallography | | 分子名称: | Parkinson disease protein 7 | | 著者 | Zielinski, K, Dolamore, C, Dalton, K, Meisburger, S, Smith, N, Termini, J, Henning, R, Srajer, V, Hekstra, D, Pollack, L, Wilson, M.A. | | 登録日 | 2024-07-15 | | 公開日 | 2025-03-12 | | 実験手法 | X-RAY DIFFRACTION (1.63 Å) | | 主引用文献 | Resolving DJ-1 Glyoxalase Catalysis Using Mix-and-Inject Serial Crystallography at a Synchrotron.
Biorxiv, 2024
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9GNG
 | | mouse VDAC1 in complex with MPD | | 分子名称: | (4S)-2-METHYL-2,4-PENTANEDIOL, 1,2-DIMYRISTOYL-SN-GLYCERO-3-PHOSPHOCHOLINE, Isoform Mt-VDAC1 of Non-selective voltage-gated ion channel VDAC1 | | 著者 | Lolicato, M, Arrigoni, C. | | 登録日 | 2024-09-03 | | 公開日 | 2025-01-08 | | 最終更新日 | 2025-01-22 | | 実験手法 | X-RAY DIFFRACTION (2.4 Å) | | 主引用文献 | Protocol for high-yield bacterial expression and purification of the voltage-dependent anion channel 1 for high-throughput biophysical assays.
STAR Protoc, 6, 2025
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6GQP
 | | Crystal structure of human KDR (VEGFR2) kinase domain in complex with AZD3229-analogue (compound 23) | | 分子名称: | Vascular endothelial growth factor receptor 2, ~{N}-[4-(6,7-dimethoxyquinazolin-4-yl)oxyphenyl]-2-(1-ethylpyrazol-4-yl)ethanamide | | 著者 | Hardy, C.J, Schimpl, M, Ogg, D.J, Overman, R.C, Packer, M.J, Kettle, J.G, Anjum, R, Barry, E, Bhavsar, D, Brown, C, Campbell, A, Goldberg, K, Grondine, M, Guichard, S, Hunt, T, Jones, O, Li, X, Moleva, O, Pearson, S, Shao, W, Smith, A, Smith, J, Stead, D, Stokes, S, Tucker, M, Ye, Y. | | 登録日 | 2018-06-07 | | 公開日 | 2018-09-19 | | 最終更新日 | 2024-01-17 | | 実験手法 | X-RAY DIFFRACTION (2.09 Å) | | 主引用文献 | Discovery of N-(4-{[5-Fluoro-7-(2-methoxyethoxy)quinazolin-4-yl]amino}phenyl)-2-[4-(propan-2-yl)-1 H-1,2,3-triazol-1-yl]acetamide (AZD3229), a Potent Pan-KIT Mutant Inhibitor for the Treatment of Gastrointestinal Stromal Tumors.
J. Med. Chem., 61, 2018
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7XB8
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7XB7
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7XB9
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9D50
 | | Structure of PAK1 in complex with compound 24 | | 分子名称: | 3-cyano-N-[3-({6-[(5-cyclopropyl-1,3-thiazol-2-yl)amino]pyrazin-2-yl}amino)bicyclo[1.1.1]pentan-1-yl]azetidine-3-carboxamide, Serine/threonine-protein kinase PAK 1 | | 著者 | Fontano, E, Suto, R.K, Olland, A.M. | | 登録日 | 2024-08-13 | | 公開日 | 2025-04-02 | | 最終更新日 | 2025-07-16 | | 実験手法 | X-RAY DIFFRACTION (1.898 Å) | | 主引用文献 | Identification of a p21-activated kinase 1 (PAK1) inhibitor with 10-fold selectivity against PAK2.
Bioorg.Med.Chem.Lett., 127, 2025
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6GQ9
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5N7G
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4AZ6
 | | Differential inhibition of the tandem GH20 catalytic modules in the pneumococcal exo-beta-D-N-acetylglucosaminidase, StrH | | 分子名称: | 1,2-ETHANEDIOL, 2,5,8,11,14,17-HEXAOXANONADECAN-19-OL, BETA-N-ACETYLHEXOSAMINIDASE, ... | | 著者 | Pluvinage, B, Stubbs, K.A, Vocadlo, D.J, Boraston, A.B. | | 登録日 | 2012-06-23 | | 公開日 | 2013-07-10 | | 最終更新日 | 2023-12-20 | | 実験手法 | X-RAY DIFFRACTION (1.36 Å) | | 主引用文献 | Inhibition of the Family 20 Glycoside Hydrolase Catalytic Modules in the Streptococcus Pneumoniae Exo-Beta-D-N-Acetylglucosaminidase, Strh.
Org.Biomol.Chem., 11, 2013
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