PDB: 68717 件ウェブページステータス検索Chemie searchBIRD

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4RUV	Crystal structure of thioredoxin 2 from Staphylococcus aureus NCTC8325 分子名称: Thioredoxin 著者 Bose, M, Biswas, R, Roychowdhury, A, Bhattacharyya, S, Ghosh, A.K, Das, A.K. 登録日 2014-11-22 公開日 2015-12-09 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.93 Å) 主引用文献 Elucidation of the mechanism of disulfide exchange between staphylococcal thioredoxin2 and thioredoxin reductase2: A structural insight. Biochimie, 160, 2019
4N9K	crystal structure of beta-lactamse PenP_E166S in complex with cephaloridine 分子名称: 5-METHYL-2-[2-OXO-1-(2-THIOPHEN-2-YL-ACETYLAMINO)-ETHYL]-3,6-DIHYDRO-2H-[1,3]THIAZINE-4-CARBOXYLIC ACID, Beta-lactamase 著者 Pan, X, Wong, W, Zhao, Y. 登録日 2013-10-21 公開日 2014-09-10 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (1.93 Å) 主引用文献 Perturbing the General Base Residue Glu166 in the Active Site of Class A beta-Lactamase Leads to Enhanced Carbapenem Binding and Acylation Biochemistry, 53, 2014
3H4C	Structure of the C-terminal Domain of Transcription Factor IIB from Trypanosoma brucei 分子名称: 1,2-ETHANEDIOL, Transcription factor TFIIB-like 著者 Syed Ibrahim, B, Kanneganti, N, Rieckhof, G.E, Das, A, Laurents, D.V, Palenchar, J.B, Bellofatto, V, Wah, D.A. 登録日 2009-04-18 公開日 2009-08-11 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Structure of the C-terminal domain of transcription factor IIB from Trypanosoma brucei. Proc.Natl.Acad.Sci.USA, 106, 2009
4MWC	Trypanosoma brucei methionyl-tRNA synthetase in complex with inhibitor 1-(3-{[(2-methyl-1-benzothiophen-3-yl)methyl]amino}propyl)-3-thiophen-3-ylurea (Chem 1540) 分子名称: 1-(3-{[(2-methyl-1-benzothiophen-3-yl)methyl]amino}propyl)-3-thiophen-3-ylurea, DIMETHYL SULFOXIDE, GLYCEROL, ... 著者 Koh, C.Y, Kim, J.E, Wetzel, A.B, de van der Schueren, W.J, Shibata, S, Liu, J, Zhang, Z, Fan, E, Verlinde, C.L.M.J, Hol, W.G.J. 登録日 2013-09-24 公開日 2014-04-30 最終更新日 2024-11-27 実験手法 X-RAY DIFFRACTION (2.649 Å) 主引用文献 Structures of Trypanosoma brucei Methionyl-tRNA Synthetase with Urea-Based Inhibitors Provide Guidance for Drug Design against Sleeping Sickness. Plos Negl Trop Dis, 8, 2014
4QYF	CHK1 kinase domain in complex with aminopyrazine compound 13 分子名称: 4-[3-amino-6-(3-hydroxyphenyl)pyrazin-2-yl]benzoic acid, Serine/threonine-protein kinase Chk1 著者 Appleton, B, Wu, P. 登録日 2014-07-24 公開日 2014-12-17 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.15 Å) 主引用文献 Discovery of the 1,7-diazacarbazole class of inhibitors of checkpoint kinase 1. Bioorg.Med.Chem.Lett., 24, 2014
1W37	2-keto-3-deoxygluconate(KDG) aldolase of Sulfolobus solfataricus 分子名称: 2-KETO-3-DEOXY GLUCONATE ALDOLASE, GLYCEROL, SODIUM ION 著者 Theodossis, A, Walden, H, Westwick, E.J, Connaris, H, Lamble, H.J, Hough, D.W, Danson, M.J, Taylor, G.L. 登録日 2004-07-13 公開日 2004-09-02 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 The structural basis for substrate promiscuity in 2-keto-3-deoxygluconate aldolase from the Entner-Doudoroff pathway in Sulfolobus solfataricus. J. Biol. Chem., 279, 2004
4OI1	Clp1 bound to ssRNA dinucleotide GC, ADP, AlF4-, and Mg2+(transition state, data set II) 分子名称: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, NONAETHYLENE GLYCOL, ... 著者 Dikfidan, A, Loll, B, Zeymer, C, Clausen, T, Meinhart, A. 登録日 2014-01-18 公開日 2014-05-14 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 RNA specificity and regulation of catalysis in the eukaryotic polynucleotide kinase clp1. Mol.Cell, 54, 2014
4QYE	CHK1 kinase domain in complex with diarylpyrazine compound 1 分子名称: 4-[6-(3-hydroxyphenyl)pyrazin-2-yl]benzoic acid, Serine/threonine-protein kinase Chk1 著者 Appleton, B, Wu, P. 登録日 2014-07-24 公開日 2014-12-17 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.05 Å) 主引用文献 Discovery of the 1,7-diazacarbazole class of inhibitors of checkpoint kinase 1. Bioorg.Med.Chem.Lett., 24, 2014
1UY4	Binding sub-site dissection of a family 6 carbohydrate-binding module by X-ray crystallography and isothermal titration calorimetry 分子名称: CALCIUM ION, ENDO-1,4-BETA-XYLANASE A, GLYCEROL, ... 著者 Van Bueren, A.L, Boraston, A.B. 登録日 2004-03-01 公開日 2004-06-18 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (1.69 Å) 主引用文献 Binding Sub-Site Dissection of a Carbohydrate-Binding Module Reveals the Contribution of Entropy to Oligosaccharide Recognition at "Non-Primary" Binding Subsites. J.Mol.Biol., 340, 2004
4QXG	Antigen binding fragment of an anti IFNAR1 antibody 分子名称: Fab, heavy chain, IgG1, ... 著者 Oganesyan, V.Y, Dall'Acqua, W.F. 登録日 2014-07-20 公開日 2015-02-25 最終更新日 2024-11-27 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Molecular basis for antagonistic activity of anifrolumab, an anti-interferon-alpha receptor 1 antibody. MAbs, 7, 2015
3O6Y	Robust computational design, optimization, and structural characterization of retroaldol enzymes 分子名称: Retro-Aldolase, SULFATE ION 著者 Althoff, E.A, Wang, L, Jiang, L, Moody, J, Bolduc, J, Lassila, J.K, Wang, Z.Z, Smith, M, Hari, S, Herschlag, D, Stoddard, B.L, Baker, D. 登録日 2010-07-29 公開日 2011-06-29 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2.091 Å) 主引用文献 Structural analyses of covalent enzyme-substrate analog complexes reveal strengths and limitations of de novo enzyme design. J.Mol.Biol., 415, 2012
1UY2	Binding sub-site dissection of a family 6 carbohydrate-binding module by X-ray crystallography and isothermal titration calorimetry 分子名称: CALCIUM ION, ENDO-1,4-BETA-XYLANASE A, GLYCEROL, ... 著者 Van Bueren, A.L, Boraston, A.B. 登録日 2004-03-01 公開日 2004-06-18 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Binding Sub-Site Dissection of a Carbohydrate-Binding Module Reveals the Contribution of Entropy to Oligosaccharide Recognition at "Non-Primary" Binding Subsites. J.Mol.Biol., 340, 2004
1Y1E	human formylglycine generating enzyme 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, C-alpha-formyglycine-generating enzyme, CALCIUM ION 著者 Rudolph, M.G, Dickmanns, A, Ficner, R. 登録日 2004-11-18 公開日 2005-05-31 最終更新日 2024-10-23 実験手法 X-RAY DIFFRACTION (1.73 Å) 主引用文献 Molecular basis for multiple sulfatase deficiency and mechanism for formylglycine generation of the human formylglycine-generating enzyme. Cell(Cambridge,Mass.), 121, 2005
3S6M	The structure of a Peptidyl-prolyl cis-trans isomerase from Burkholderia pseudomallei 分子名称: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, Peptidyl-prolyl cis-trans isomerase 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2011-05-25 公開日 2011-06-08 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.651 Å) 主引用文献 The structure of a Peptidyl-prolyl cis-trans isomerase from Burkholderia pseudomallei TO BE PUBLISHED
3NVS	1.02 Angstrom resolution crystal structure of 3-phosphoshikimate 1-carboxyvinyltransferase from Vibrio cholerae in complex with shikimate-3-phosphate (partially photolyzed) and glyphosate 分子名称: (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-1-ENE-1-CARBOXYLIC ACID, 3-phosphoshikimate 1-carboxyvinyltransferase, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ... 著者 Minasov, G, Light, S.H, Halavaty, A, Shuvalova, G, Papazisi, L, Anderson, W.F, Center for Structural Genomics of Infectious Diseases (CSGID) 登録日 2010-07-08 公開日 2010-07-21 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.021 Å) 主引用文献 1.02 Angstrom Resolution Crystal Structure of 3-Phosphoshikimate 1-Carboxyvinyltransferase from Vibrio cholerae in complex with Shikimate-3-Phosphate (Partially Photolyzed) and Glyphosate TO BE PUBLISHED
4LHN	Structure of the N-terminal domain of the Flo1 adhesin (N-Flo1p) from the yeast Saccharomyces cerevisiae, in complex with calcium and mannose 分子名称: CALCIUM ION, Flocculation protein FLO1, alpha-D-mannopyranose 著者 Ielasi, F.S, Willaert, R.G. 登録日 2013-07-01 公開日 2014-09-24 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (2.12 Å) 主引用文献 Molecular mechanism of flocculation self-recognition in yeast and its role in mating and survival. MBio, 6, 2015
6TYR	Crystal structure of Laccase from Thermus thermophilus HB27 with a close conformation of its beta-hairpin 分子名称: CITRIC ACID, COPPER (II) ION, GLYCEROL, ... 著者 Miranda-Blancas, R, Rudino-Pinera, E. 登録日 2019-08-09 公開日 2020-08-12 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.813 Å) 主引用文献 The beta-hairpin from the Thermus thermophilus HB27 laccase works as a pH-dependent switch to regulate laccase activity. J.Struct.Biol., 213, 2021
4LIT	Structure of YcfD a Ribosomal oxygenase from Escherichia coli in complex with Cobalt and 2-oxoglutarate. 分子名称: 2-OXOGLUTARIC ACID, 50S ribosomal protein L16 arginine hydroxylase, COBALT (II) ION 著者 Brissett, N.C, Doherty, A.J. 登録日 2013-07-03 公開日 2014-05-14 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Ribosomal oxygenases are structurally conserved from prokaryotes to humans. Nature, 509, 2014
4U6E	HsMetAP in complex with (amino(phenyl)methyl)phosphonic acid 分子名称: COBALT (II) ION, Methionine aminopeptidase 1, [(R)-amino(phenyl)methyl]phosphonic acid 著者 Arya, T, Addlagatta, A. 登録日 2014-07-28 公開日 2015-03-25 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Identification of the Molecular Basis of Inhibitor Selectivity between the Human and Streptococcal Type I Methionine Aminopeptidases J.Med.Chem., 58, 2015
3K9H	Crystal structure of a plasmid partition protein from borrelia burgdorferi at 2.25A resolution 分子名称: PF-32 protein, SULFATE ION 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2009-10-15 公開日 2009-11-03 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2.25 Å) 主引用文献 Crystal structure of a plasmid partition protein from borrelia burgdorferi at 2.25A resolution To be Published
4U6R	Crystal structure of human IRE1 cytoplasmic domains in complex with a sulfonamide inhibitor. 分子名称: 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, N-{4-[(3-{2-[(trans-4-aminocyclohexyl)amino]pyrimidin-4-yl}pyridin-2-yl)oxy]-3-methylnaphthalen-1-yl}-2-chlorobenzenesulfonamide, ... 著者 Mohr, C. 登録日 2014-07-29 公開日 2014-10-08 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Unfolded Protein Response in Cancer: IRE1 alpha Inhibition by Selective Kinase Ligands Does Not Impair Tumor Cell Viability. Acs Med.Chem.Lett., 6, 2015
5JNC	Crystal structure for the complex of human carbonic anhydrase IV and 4-aminomethylbenzene sulfonamide 分子名称: 4-(aminomethyl)benzene-1-sulfonamide, ACETATE ION, Carbonic anhydrase 4, ... 著者 Chen, Z, Waheed, A, Di Cera, E, Sly, W.S. 登録日 2016-04-29 公開日 2017-05-03 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Intrinsic thermodynamics of high affinity inhibitor binding to recombinant human carbonic anhydrase IV. Eur. Biophys. J., 47, 2018
3SNZ	Crystal structure of a mutant W39D of a betagamma-crystallin domain from Clostridium beijerinckii 分子名称: CALCIUM ION, Clostrillin 著者 Srivastava, S.S, Sankaranarayanan, R. 登録日 2011-06-29 公開日 2011-11-16 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Decoding the molecular design principles underlying Ca(2+) binding to beta gamma-crystallin motifs J.Mol.Biol., 415, 2012
4TX4	Crystal Structure of a Single-Domain Cysteine Protease Inhibitor from Cowpea (Vigna unguiculata) 分子名称: Cysteine proteinase inhibitor, SULFATE ION 著者 Pereira, H.M, Valadares, N, Monteiro-Junior, J.E, Carvalho, C.P.S, Grangeiro, T.B. 登録日 2014-07-02 公開日 2015-10-14 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Expression in Escherichia coli of cysteine protease inhibitors from cowpea (Vigna unguiculata): The crystal structure of a single-domain cystatin gives insights on its thermal and pH stability. Int. J. Biol. Macromol., 102, 2017
3SKG	Crystal structure of beta-site app-cleaving enzyme 1 (BACE-WT) complex with (2S)-2-((3R)-3-acetamido-3-isobutyl-2-oxo-1-pyrrolidinyl)-N-((1S,2R)-1-(3,5-difluorobenzyl)-2-hydroxy-2-(1,2,3,4-tetrahydro-3-isoquinolinyl)ethyl)-4-phenylbutanamide 分子名称: (2S)-2-[(3R)-3-(acetylamino)-3-(2-methylpropyl)-2-oxopyrrolidin-1-yl]-N-{(1R,2S)-3-(3,5-difluorophenyl)-1-hydroxy-1-[(3R)-1,2,3,4-tetrahydroisoquinolin-3-yl]propan-2-yl}-4-phenylbutanamide, Beta-secretase 1 著者 Muckelbauer, J.K. 登録日 2011-06-22 公開日 2011-09-07 最終更新日 2024-11-27 実験手法 X-RAY DIFFRACTION (2.88 Å) 主引用文献 Synthesis and in vivo evaluation of cyclic diaminopropane BACE-1 inhibitors. Bioorg.Med.Chem.Lett., 21, 2011

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