PDB: 36840 件ウェブページステータス検索Chemie searchBIRD

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4PRJ	Aurora A kinase domain with compound 2 (N-[1-(3-cyanobenzyl)-1H-pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide) 分子名称: Aurora kinase A, N-[1-(3-cyanobenzyl)-1H-pyrazol-4-yl]-6-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide 著者 Ultsch, M, Eigenbrot, C. 登録日 2014-03-05 公開日 2014-07-02 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 Property- and structure-guided discovery of a tetrahydroindazole series of interleukin-2 inducible T-cell kinase inhibitors. J.Med.Chem., 57, 2014
5WPM	KRas G12V, bound to GppNHp and miniprotein 225-11(A30R) 分子名称: GTPase KRas, MAGNESIUM ION, PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER, ... 著者 Lee, S.-J, Shim, S.Y, McGee, J.H, Verdine, G.L. 登録日 2017-08-05 公開日 2018-01-03 最終更新日 2018-03-14 実験手法 X-RAY DIFFRACTION (1.72 Å) 主引用文献 Exceptionally high-affinity Ras binders that remodel its effector domain. J. Biol. Chem., 293, 2018
6L7K	solution structure of hIFABP V60C/Y70C variant. 分子名称: Fatty acid-binding protein, intestinal 著者 Fan, J, Yang, D. 登録日 2019-11-01 公開日 2020-11-04 最終更新日 2023-06-14 実験手法 SOLUTION NMR 主引用文献 Ligand Entry into Fatty Acid Binding Protein via Local Unfolding Instead of Gap Widening. Biophys.J., 118, 2020
5WIW	Crystal structure of murine 4-1BB N128A mutant from HEK293T cells in P43 space group 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, GLYCEROL, SULFATE ION, ... 著者 Zajonc, D.M, Bitra, A. 登録日 2017-07-20 公開日 2017-12-20 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Crystal structure of murine 4-1BB and its interaction with 4-1BBL support a role for galectin-9 in 4-1BB signaling. J. Biol. Chem., 293, 2018
6ETC	Crystal Structure of Human gamma-D-crystallin Mutant P23T+R36S at 1.2 Angstroms Resolution 分子名称: Gamma-crystallin D 著者 Khan, A.R, McManus, J. 登録日 2017-10-26 公開日 2018-11-07 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.197 Å) 主引用文献 Temperature-Dependent Interactions Explain Normal and Inverted Solubility in a gamma D-Crystallin Mutant. Biophys.J., 117, 2019
4PFP	Myosin VI motor domain in the Pi release state (with Pi) space group P21 分子名称: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, PHOSPHATE ION, ... 著者 Isabet, T, Benisty, H, Llinas, P, Sweeney, H.L, Houdusse, A. 登録日 2014-04-30 公開日 2015-04-29 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2.32 Å) 主引用文献 How actin initiates the motor activity of Myosin. Dev.Cell, 33, 2015
5WJK	2.0-Angstrom In situ Mylar structure of sperm whale myoglobin (SWMb) at 293 K 分子名称: CHLORIDE ION, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ... 著者 Broecker, J, Ou, W.-L, Ernst, O.P. 登録日 2017-07-23 公開日 2017-12-13 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 High-throughput in situ X-ray screening of and data collection from protein crystals at room temperature and under cryogenic conditions. Nat Protoc, 13, 2018
4PHF	Crystal structure of Ypt7 covalently modified with GDP 分子名称: GTP-binding protein YPT7, MAGNESIUM ION, N-[3-(propanoylamino)propyl]guanosine 5'-(trihydrogen diphosphate), ... 著者 Vieweg, S, Wiegandt, D, Hofmann, F, Koch, D, Wu, Y, Itzen, A, Mueller, M.P, Goody, R.S. 登録日 2014-05-06 公開日 2014-05-28 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Locking GTPases covalently in their functional states. Nat Commun, 6, 2015
5WLO	a novel 13-ring macrocyclic HIV-1 protease inhibitors involving the P1'-P2' ligands 分子名称: (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl {(2S,3R)-3-hydroxy-4-[(7E)-13-methoxy-1,1-dioxo-1,4,5,6,9,11-hexahydro-10,1lambda~6~,2-benzoxathiazacyclotridecin-2(3H)-yl]-1-phenylbutan-2-yl}carbamate, ACETATE ION, CHLORIDE ION, ... 著者 Wang, Y.-F, Agniswamy, J, Weber, I.T. 登録日 2017-07-27 公開日 2017-10-11 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.27 Å) 主引用文献 Design, synthesis, X-ray studies, and biological evaluation of novel macrocyclic HIV-1 protease inhibitors involving the P1'-P2' ligands. Bioorg. Med. Chem. Lett., 27, 2017
6EW2	Human myelin protein P2 F57A mutant, tetragonal crystal form 分子名称: CHLORIDE ION, Myelin P2 protein, PALMITIC ACID 著者 Laulumaa, S, Lehtimaki, M, Kursula, P. 登録日 2017-11-03 公開日 2018-07-11 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.588 Å) 主引用文献 Structure and dynamics of a human myelin protein P2 portal region mutant indicate opening of the beta barrel in fatty acid binding proteins. BMC Struct. Biol., 18, 2018
6EW5	Human myelin protein P2 F57A mutant, monoclinic crystal form 分子名称: Myelin P2 protein, PALMITIC ACID 著者 Laulumaa, S, Lehtimaki, M, Kursula, P. 登録日 2017-11-03 公開日 2018-07-11 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Structure and dynamics of a human myelin protein P2 portal region mutant indicate opening of the beta barrel in fatty acid binding proteins. BMC Struct. Biol., 18, 2018
6C2I	Structure of Bace-1 (Beta-Secretase) in complex with : N-(3-((1R,5S,6R)-3-amino-5-methyl-2-oxa-4-azabicyclo[4.1.0]hept-3-en-5-yl)-4-fluorophenyl)-5-methoxypyrazine-2-carboxamide 分子名称: Beta-secretase 1, GLYCEROL, IODIDE ION, ... 著者 Sickmier, E.A. 登録日 2018-01-08 公開日 2018-02-21 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Diastereoselective synthesis of fused cyclopropyl-3-amino-2,4-oxazine beta-amyloid cleaving enzyme (BACE) inhibitors and their biological evaluation. Bioorg. Med. Chem. Lett., 28, 2018
4PJN	Myosin VI motor domain in the Pi release state, space group P212121 - shortly soaked with PO4 分子名称: ADENOSINE-5'-DIPHOSPHATE, GLYCEROL, MAGNESIUM ION, ... 著者 Isabet, T, Benisty, H, Llinas, P, Sweeney, H.L, Houdusse, A. 登録日 2014-05-12 公開日 2015-04-29 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 How actin initiates the motor activity of Myosin. Dev.Cell, 33, 2015
6C2R	Aurora A ligand complex 分子名称: (2R,4R)-1-[(3-chloro-2-fluorophenyl)methyl]-4-({3-fluoro-6-[(5-methyl-1H-pyrazol-3-yl)amino]pyridin-2-yl}methyl)-2-methylpiperidine-4-carboxylic acid, Aurora kinase A, SULFATE ION 著者 Antonysamy, S, Pustilnik, A, Manglicmot, D, Froning, K, Weichert, K, Wasserman, S. 登録日 2018-01-08 公開日 2019-01-23 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.96 Å) 主引用文献 Aurora A Kinase Inhibition Is Synthetic Lethal with Loss of theRB1Tumor Suppressor Gene. Cancer Discov, 9, 2019
6F8C	Crystal structure of cytochrome P450 CYP260A1 (S276I) bound with progesterone 分子名称: Cytochrome P450 CYP260A1, PROGESTERONE, PROTOPORPHYRIN IX CONTAINING FE 著者 Jozwik, I.K, Thunnissen, A.M.W.H. 登録日 2017-12-12 公開日 2018-03-14 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structure-Based Engineering of Steroidogenic CYP260A1 for Stereo- and Regioselective Hydroxylation of Progesterone. ACS Chem. Biol., 13, 2018
6C40	CheY41PyTyrD54K from Thermotoga maritima 分子名称: COPPER (II) ION, Chemotaxis protein CheY 著者 Merz, G.E, Muok, A.R, Crane, B.R. 登録日 2018-01-11 公開日 2018-10-17 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Site-Specific Incorporation of a Cu2+Spin Label into Proteins for Measuring Distances by Pulsed Dipolar Electron Spin Resonance Spectroscopy. J Phys Chem B, 122, 2018
6FAD	SR protein kinase 1 (SRPK1) in complex with the RGG-box of HSV1 ICP27 分子名称: PHOSPHATE ION, SRSF protein kinase 1, mRNA export factor 著者 Tunnicliffe, R.B, Levy, C, Mould, A.P, Mckenzie, E.A, Sandri-Goldin, R.M, Golovanov, A.P. 登録日 2017-12-15 公開日 2019-09-25 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.801 Å) 主引用文献 Molecular Mechanism of SR Protein Kinase 1 Inhibition by the Herpes Virus Protein ICP27. Mbio, 10, 2019
6LOG	Crystal structure of human CCL5-12AAA14 mutant 分子名称: C-C motif chemokine 5 著者 Chen, Y.C, Li, J.Y, Huang, C.H, Sue, S.C. 登録日 2020-01-05 公開日 2020-03-18 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (2.55 Å) 主引用文献 N-terminal Backbone Pairing Shifts in CCL5- 12 AAA 14 Dimer Interface: Structural Significance of the FAY Sequence. Int J Mol Sci, 21, 2020
5WNJ	Crystal structure of murine receptor-interacting protein kinase 4 (Ripk4) D143N in complex with lestaurtinib 分子名称: CHLORIDE ION, Lestaurtinib, Receptor-interacting serine/threonine-protein kinase 4 著者 Huang, C.S, Hymowitz, S.G. 登録日 2017-08-01 公開日 2018-05-09 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (2.55 Å) 主引用文献 Crystal Structure of Ripk4 Reveals Dimerization-Dependent Kinase Activity. Structure, 26, 2018
4POM	Crystal structures of thioredoxin with mesna at 1.85A resolution 分子名称: 1-THIOETHANESULFONIC ACID, Thioredoxin 著者 Sridhar, V, Chie-Leon, B, Badger, J, Nienaber, V.L, Hausheer, F.H. 登録日 2014-02-26 公開日 2014-10-29 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 BNP7787 Forms Novel Covalent Adducts on Human Thioredoxin and Modulates Thioredoxin Activity J Pharmacol Clin Toxicol, 2, 2014
6ETP	Atomic resolution structure of RNase A (data collection 6) 分子名称: ISOPROPYL ALCOHOL, Ribonuclease pancreatic 著者 Caterino, M, Vergara, A, Merlino, A. 登録日 2017-10-27 公開日 2018-02-21 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.02 Å) 主引用文献 Raman-markers of X-ray radiation damage of proteins. Int. J. Biol. Macromol., 111, 2018
7O0K	Crystal structure of recombinant chichen liver Bile Acid Binding Protein (cL-BABP) in complex with cholic acid 分子名称: CHOLIC ACID, Fatty acid-binding protein, liver 著者 Tassone, G, Pozzi, C. 登録日 2021-03-26 公開日 2021-05-12 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.83 Å) 主引用文献 Validation of Recombinant Chicken Liver Bile Acid Binding Protein as a Tool for Cholic Acid Hosting. Biomolecules, 11, 2021
6ETK	Atomic resolution structure of RNase A (data collection 1) 分子名称: ISOPROPYL ALCOHOL, Ribonuclease pancreatic 著者 Caterino, M, Vergara, A, Merlino, A. 登録日 2017-10-27 公開日 2018-02-21 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (0.85 Å) 主引用文献 Raman-markers of X-ray radiation damage of proteins. Int. J. Biol. Macromol., 111, 2018
7O0J	High resolution structure of recombinant chichen liver Bile Acid Binding Protein (cL-BABP) 分子名称: Fatty acid-binding protein, liver 著者 Tassone, G, Pozzi, C. 登録日 2021-03-26 公開日 2021-05-12 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Validation of Recombinant Chicken Liver Bile Acid Binding Protein as a Tool for Cholic Acid Hosting. Biomolecules, 11, 2021
6ETQ	Atomic resolution structure of RNase A (data collection 7) 分子名称: ISOPROPYL ALCOHOL, Ribonuclease pancreatic 著者 Caterino, M, Vergara, A, Merlino, A. 登録日 2017-10-27 公開日 2018-02-21 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.08 Å) 主引用文献 Raman-markers of X-ray radiation damage of proteins. Int. J. Biol. Macromol., 111, 2018

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