PDB: 37084 件ウェブページステータス検索Chemie searchBIRD

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3E3E	Human Thioredoxin Double Mutant C35S,C73R 分子名称: HEXAETHYLENE GLYCOL, Thioredoxin 著者 Hall, G, Emsley, J. 登録日 2008-08-07 公開日 2010-03-02 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (2.01 Å) 主引用文献 Structure of human thioredoxin exhibits a large conformational change. Protein Sci., 19, 2010
4HVL	Structure of a serine protease MycP1, an essential component of the type VII (ESX-1) secretion system 分子名称: ACETATE ION, CHLORIDE ION, IMIDAZOLE, ... 著者 Korotkov, K.V, Evans, T.J. 登録日 2012-11-06 公開日 2013-05-08 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Understanding specificity of the mycosin proteases in ESX/type VII secretion by structural and functional analysis. J.Struct.Biol., 184, 2013
4HVW	Crystal structure of the T98E c-Src-SH3 domain mutant in complex with the high affinity peptide VSL12 分子名称: ACETYL GROUP, Proto-oncogene tyrosine-protein kinase Src, SULFATE ION, ... 著者 Camara-Artigas, A. 登録日 2012-11-07 公開日 2013-05-01 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (0.98 Å) 主引用文献 Atomic resolution structures of the c-Src SH3 domain in complex with two high-affinity peptides from classes I and II. Acta Crystallogr.,Sect.D, 69, 2013
4DUD	cytochrome P450 BM3h-2G9C6 MRI sensor, no ligand 分子名称: PROTOPORPHYRIN IX CONTAINING FE, cytochrome P450 BM3 variant 2G9C6 著者 Brustad, E.M, Lelyveld, V.S, Snow, C.D, Crook, N, Martinez, F.M, Scholl, T.J, Jasanoff, A, Arnold, F.H. 登録日 2012-02-21 公開日 2012-06-13 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Structure-guided directed evolution of highly selective p450-based magnetic resonance imaging sensors for dopamine and serotonin. J.Mol.Biol., 422, 2012
4DUC	cytochrome P450 BM3h-2G9 MRI sensor, no ligand 分子名称: PROTOPORPHYRIN IX CONTAINING FE, cytochrome P450 BM3 variant 2G9 著者 Brustad, E.M, Lelyveld, V.S, Snow, C.D, Crook, N, Martinez, F.M, Scholl, T.J, Jasanoff, A, Arnold, F.H. 登録日 2012-02-21 公開日 2012-06-13 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.92 Å) 主引用文献 Structure-guided directed evolution of highly selective p450-based magnetic resonance imaging sensors for dopamine and serotonin. J.Mol.Biol., 422, 2012
4DW2	The crystal structure of uPA in complex with the Fab fragment of mAb-112 分子名称: Fab fragment of pro-uPA antibody mAb-112, SULFATE ION, Urokinase-type plasminogen activator 著者 Jiang, L, Botkjaer, K.A, Andersen, L.M, Yuan, C, Andreasen, P.A, Huang, M. 登録日 2012-02-24 公開日 2013-01-16 実験手法 X-RAY DIFFRACTION (2.97 Å) 主引用文献 Rezymogenation of active urokinase induced by an inhibitory antibody. Biochem.J., 449, 2013
4DX1	Crystal structure of the human TRPV4 ankyrin repeat domain 分子名称: GLYCEROL, PHOSPHATE ION, Transient receptor potential cation channel subfamily V member 4 著者 Inada, H, Gaudet, R. 登録日 2012-02-27 公開日 2012-07-18 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.85 Å) 主引用文献 Structural and biochemical consequences of disease-causing mutations in the ankyrin repeat domain of the human TRPV4 channel. Biochemistry, 51, 2012
4B05	Preclinical characterization of AZD3839, a novel clinical candidate BACE1 inhibitor for the treatment of Alzheimer Disease 分子名称: (1S)-1-[2-(difluoromethyl)pyridin-4-yl]-4-fluoro-1-(3-pyrimidin-5-ylphenyl)-1H-isoindol-3-amine, ACETATE ION, BETA-SECRETASE 1, ... 著者 Jeppsson, F, Eketjall, S, Janson, J, Karlstrom, S, Gustavsson, S, Olsson, L.L, Radesater, A.C, Ploeger, B, Cebers, G, Kolmodin, K, Swahn, B.M, von Berg, S, Bueters, T, Falting, J. 登録日 2012-06-28 公開日 2012-10-17 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Discovery of AZD3839, a potent and selective BACE1 inhibitor clinical candidate for the treatment of Alzheimer disease. J. Biol. Chem., 287, 2012
4AYA	Crystal structure of ID2 HLH homodimer at 2.1A resolution 分子名称: ACETATE ION, DNA-BINDING PROTEIN INHIBITOR ID-2, POTASSIUM ION 著者 Wong, M.V, Jiang, S, Palasingam, P, Kolatkar, P.R. 登録日 2012-06-19 公開日 2012-11-14 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (2.103 Å) 主引用文献 A Divalent Ion is Crucial in the Structure and Dominant-Negative Function of Id Proteins, a Class of Helix-Loop-Helix Transcription Regulators. Plos One, 7, 2012
4B4I	1.20 A Structure of Lysozyme Crystallized with (S)-2-methyl-2,4- pentanediol 分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, CHLORIDE ION, LYSOZYME C 著者 Jakoncic, J, Berger, J, Stauber, M, Axelbaum, A, Asherie, N. 登録日 2012-07-30 公開日 2012-08-22 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (1.2 Å) 主引用文献 Crystallization of Lysozyme with (R)-, (S)- and (Rs)-2-Methyl-2,4-Pentanediol Acta Crystallogr.,Sect.D, 71, 2015
3EBS	Human Cytochrome P450 2A6 I208S/I300F/G301A/S369G in complex with Phenacetin 分子名称: Cytochrome P450 2A6, N-(4-ethoxyphenyl)acetamide, PROTOPORPHYRIN IX CONTAINING FE 著者 DeVore, N.M, Scott, E.E. 登録日 2008-08-28 公開日 2008-09-23 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (2.15 Å) 主引用文献 Key residues controlling phenacetin metabolism by human cytochrome P4502A enzymes. Drug Metab.Dispos., 36, 2008
3EBA	CAbHul6 FGLW mutant (humanized) in complex with human lysozyme 分子名称: CAbHul6, Lysozyme C, SULFATE ION 著者 Loris, R, Vincke, C, Saerens, D, Martinez-Rodriguez, S, Muyldermans, S, Conrath, K. 登録日 2008-08-27 公開日 2008-12-02 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 General Strategy to Humanize a Camelid Single-domain Antibody and Identification of a Universal Humanized Nanobody Scaffold J.Biol.Chem., 284, 2009
3ED3	Crystal Structure of the Yeast Dithiol/Disulfide Oxidoreductase Mpd1p 分子名称: 1,2-ETHANEDIOL, ACETATE ION, Protein disulfide-isomerase MPD1 著者 Vitu, E, Greenblatt, H.M, Fass, D. 登録日 2008-09-02 公開日 2008-11-04 最終更新日 2011-07-13 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Yeast Mpd1p reveals the structural diversity of the protein disulfide isomerase family J.Mol.Biol., 384, 2008
3ZEK	Hen egg-white lysozyme structure determined at room temperature by in- situ diffraction in ChipX 分子名称: CHLORIDE ION, LYSOZYME C 著者 Pinker, F, Lorber, B, Sauter, C. 登録日 2012-12-05 公開日 2012-12-26 最終更新日 2023-12-20 実験手法 X-RAY DIFFRACTION (1.43 Å) 主引用文献 Chipx: A Novel Microfluidic Chip for Counter- Diffusion Crystallization of Biomolecules and in Situ Crystal Analysis at Room Temperature To be Published
4IAX	Engineered human lipocalin 2 (CL31) in complex with Y-DTPA 分子名称: N-{(1S,2S)-2-[bis(carboxymethyl)amino]cyclohexyl}-N-{(2R)-2-[bis(carboxymethyl)amino]-3-[4-({[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]carbamothioyl}amino)phenyl]propyl}glycine, Neutrophil gelatinase-associated lipocalin, YTTRIUM (III) ION 著者 Eichinger, A, Skerra, A. 登録日 2012-12-07 公開日 2013-06-19 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structure-guided engineering of Anticalins with improved binding behavior and biochemical characteristics for application in radio-immuno imaging and/or therapy J.Struct.Biol., 185, 2014
4HVU	Crystal structure of the T98D c-Src-SH3 domain mutant in complex with the high affinity peptide APP12 分子名称: ACETYL GROUP, Proto-oncogene tyrosine-protein kinase Src, SULFATE ION, ... 著者 Camara-Artigas, A. 登録日 2012-11-07 公開日 2013-05-01 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (0.98 Å) 主引用文献 Atomic resolution structures of the c-Src SH3 domain in complex with two high-affinity peptides from classes I and II. Acta Crystallogr.,Sect.D, 69, 2013
3EG3	Crystal structure of the N114A mutant of ABL-SH3 domain 分子名称: GLYCEROL, Proto-oncogene tyrosine-protein kinase ABL1 著者 Camara-Artigas, A. 登録日 2008-09-10 公開日 2009-09-15 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Role of interfacial water molecules in proline-rich ligand recognition by the Src homology 3 domain of Abl. J.Biol.Chem., 285, 2010
3ZOV	CRYSTAL STRUCTURE OF BACE-1 IN COMPLEX WITH CHEMICAL LIGAND 分子名称: 5-(2,2,2-Trifluoro-ethoxy)-pyridine-2-carboxylic acid [3-((S)-2-amino-1,4-dimethyl-6-oxo-1,4,5,6-tetrahydro-pyrimidin-4-yl)-phenyl]-amide, BETA-SECRETASE 1, DIMETHYL SULFOXIDE, ... 著者 Banner, D.W, Kuglstatter, A, Benz, J, Stihle, M, Ruf, A. 登録日 2013-02-25 公開日 2013-05-29 最終更新日 2023-12-20 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Mapping the Conformational Space Accessible to Bace2 Using Surface Mutants and Co-Crystals with Fab-Fragments, Fynomers, and Xaperones Acta Crystallogr.,Sect.D, 69, 2013
3EKB	Crystal structure of the A264C mutant heme domain of cytochrome P450 BM3 分子名称: Cytochrome P450(BM-3), PROTOPORPHYRIN IX CONTAINING FE 著者 Leys, D. 登録日 2008-09-19 公開日 2008-12-30 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Novel haem co-ordination variants of flavocytochrome P450BM3. Biochem.J., 417, 2009
3EKU	Crystal Structure of Monomeric Actin bound to Cytochalasin D 分子名称: (3S,3aR,4S,6S,6aR,7E,10S,12R,13E,15R,15aR)-3-benzyl-6,12-dihydroxy-4,10,12-trimethyl-5-methylidene-1,11-dioxo-2,3,3a,4,5,6,6a,9,10,11,12,15-dodecahydro-1H-cycloundeca[d]isoindol-15-yl acetate, ADENOSINE-5'-TRIPHOSPHATE, Actin-5C, ... 著者 Nair, U.B, Joel, P.B, Wan, Q, Lowey, S, Rould, M.A, Trybus, K.M. 登録日 2008-09-19 公開日 2008-10-07 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Crystal structures of monomeric actin bound to cytochalasin D. J.Mol.Biol., 384, 2008
3ZPR	Thermostabilised turkey beta1 adrenergic receptor with 4-methyl-2-(piperazin-1-yl) quinoline bound 分子名称: 4-METHYL-2-(PIPERAZIN-1-YL) QUINOLINE, BETA-1 ADRENERGIC RECEPTOR, CHOLESTEROL HEMISUCCINATE, ... 著者 Christopher, J.A, Congreve, M, Dore, A.S, Marshall, F.H, Myszka, D.G, Brown, J, Koglin, M, Tehan, B, Errey, J.C, Tate, C.G, Warne, T. 登録日 2013-03-01 公開日 2013-04-03 最終更新日 2023-12-20 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Biophysical Fragment Screening of the Beta1-Adrenergic Receptor: Identification of High Affinity Aryl Piperazine Leads Using Structure-Based Drug Design. J.Med.Chem., 56, 2013
3ZOO	Structure of the Y46F mutant of human cytochrome c 分子名称: CYTOCHROME C, HEME C, PHOSPHATE ION 著者 Rajagopal, B.S, Worrall, J.A.R, Hough, M.A. 登録日 2013-02-22 公開日 2013-10-23 最終更新日 2023-12-20 実験手法 X-RAY DIFFRACTION (1.35 Å) 主引用文献 The Hydrogen Peroxide Induced Radical Behaviour in Human Cytochrome C Phospholipid Complexes: Implications for the Enhanced Pro-Apoptotic Activity of the G41S Mutant Biochem.J., 456, 2013
4HZZ	Crystal structure of influenza neuraminidase N3-H274Y complexed with oseltamivir 分子名称: (3R,4R,5S)-4-(acetylamino)-5-amino-3-(pentan-3-yloxy)cyclohex-1-ene-1-carboxylic acid, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, CALCIUM ION, ... 著者 Li, Q, Qi, J, Vavricka, C.J, Gao, G.F. 登録日 2012-11-16 公開日 2013-11-06 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.601 Å) 主引用文献 Functional and structural analysis of influenza virus neuraminidase N3 offers further insight into the mechanisms of oseltamivir resistance. J.Virol., 87, 2013
4I11	Structure-based design of novel dihydroisoquinoline BACE-1 inhibitors that do not engage the catalytic aspartates. 分子名称: Beta-secretase 1, N-(3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-L-phenylalanine, ZINC ION 著者 Bowers, B, Xu, Y, Yuan, S, Probst, G.D, Hom, R.K, Chan, W, Konradi, A.W, Sham, H.L, Zhu, Y.L, Beroza, P, Pan, H, Brecht, E, Yao, N, Lougheed, J, Artis, D.R, Tam, D, Bova, M. 登録日 2012-11-19 公開日 2013-03-06 最終更新日 2013-04-24 実験手法 X-RAY DIFFRACTION (1.89 Å) 主引用文献 Structure-based design of novel dihydroisoquinoline BACE-1 inhibitors that do not engage the catalytic aspartates. Bioorg.Med.Chem.Lett., 23, 2013
4I0F	Design and Synthesis of Thiophene Dihydroisoquinolins as Novel BACE-1 Inhibitors 分子名称: Beta-secretase 1, N-(6-chloro-3,3-dimethyl-3,4-dihydroisoquinolin-1-yl)-3-[4-(1H-pyrazol-4-yl)thiophen-3-yl]-L-alanine, ZINC ION 著者 Yao, N, Brecht, E. 登録日 2012-11-16 公開日 2013-03-06 最終更新日 2013-07-03 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Design and synthesis of thiophene dihydroisoquinolines as novel BACE1 inhibitors. Bioorg.Med.Chem.Lett., 23, 2013

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