PDB: 66478 件ウェブページステータス検索Chemie searchBIRD

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4RMG	Human Sirt2 in complex with SirReal2 and NAD+ 分子名称: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]-N-[5-(naphthalen-1-ylmethyl)-1,3-thiazol-2-yl]acetamide, NAD-dependent protein deacetylase sirtuin-2, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... 著者 Rumpf, T, Schiedel, M, Karaman, B, Roessler, C, North, B.J, Lehotzky, A, Olah, J, Ladwein, K.I, Schmidtkunz, K, Gajer, M, Pannek, M, Steegborn, C, Sinclair, D.A, Gerhardt, S, Ovadi, J, Schutkowski, M, Sippl, W, Einsle, O, Jung, M. 登録日 2014-10-21 公開日 2015-02-25 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.88 Å) 主引用文献 Selective Sirt2 inhibition by ligand-induced rearrangement of the active site. Nat Commun, 6, 2015
4RV2	Crystal Structure of (3R)-hydroxyacyl-ACP dehydratase HadAB hetero-dimer from Mycobacterium smegmatis 分子名称: MaoC family protein, SULFATE ION, UPF0336 protein MSMEG_1340/MSMEI_1302 著者 Biswas, R, Hazra, D, Dutta, D, Das, A.K. 登録日 2014-11-24 公開日 2015-02-11 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Crystal structure of dehydratase component HadAB complex of mycobacterial FAS-II pathway. Biochem.Biophys.Res.Commun., 458, 2015
4RVK	CHK1 kinase domain with diazacarbazole compound 8: N-[3-(6-cyano-9H-pyrrolo[2,3-b:5,4-c']dipyridin-3-yl)phenyl]acetamide 分子名称: N-[3-(6-cyano-9H-pyrrolo[2,3-b:5,4-c']dipyridin-3-yl)phenyl]acetamide, Serine/threonine-protein kinase Chk1 著者 Wiesmann, C, Wu, P. 登録日 2014-11-26 公開日 2015-06-03 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Mitigation of Acetylcholine Esterase Activity in the 1,7-Diazacarbazole Series of Inhibitors of Checkpoint Kinase 1. J.Med.Chem., 58, 2015
4PTK	Crystal structure of Staphylococcal IMPase-I complex with 3Mg2+ and Phosphate 分子名称: GLYCEROL, Inositol monophosphatase family protein, MAGNESIUM ION, ... 著者 Dutta, A, Bhattacharyya, S, Dutta, D, Das, A.K. 登録日 2014-03-11 公開日 2014-10-22 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.503 Å) 主引用文献 Structural elucidation of the binding site and mode of inhibition of Li(+) and Mg(2+) in inositol monophosphatase. Febs J., 281, 2014
4DG5	Crystal structure of staphylococcal Phosphoglycerate kinase 分子名称: Phosphoglycerate kinase 著者 Roychowdhury, A, Mukherjee, S, Dutta, D, Das, A.K. 登録日 2012-01-25 公開日 2013-01-30 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Structure based functional analysis of Staphylococcal Phosphoglycerate kinase To be Published
4ESI	Structure of ricin A chain bound with N-((1H-1,2,3-triazol-4-yl)methyl-2-amino-4-oxo-3,4-dihydropteridine-7-carboxamide 分子名称: 2-amino-4-oxo-N-(1H-1,2,3-triazol-5-ylmethyl)-1,4-dihydropteridine-7-carboxamide, Ricin 著者 Jasheway, K.R, Pruet, J.M, Ryoto, S, Manzano, L.A, Wiget, P.A, Kamat, I, Anslyn, E.V, Monzingo, A.F, Robertus, J.D. 登録日 2012-04-23 公開日 2012-10-31 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.87 Å) 主引用文献 Optimized 5-membered heterocycle-linked pterins for the inhibition of Ricin Toxin A. ACS Med Chem Lett, 3, 2012
4RVM	CHK1 kinase domain with diazacarbazole compound 19 分子名称: 3-[4-(piperidin-1-ylmethyl)phenyl]-9H-pyrrolo[2,3-b:5,4-c']dipyridine-6-carbonitrile, Serine/threonine-protein kinase Chk1 著者 Gazzard, L, Blackwood, E, Burton, B, Chapman, K, Chen, H, Crackett, P, Drobnick, J, Ellwood, C, Epler, J, Flagella, M, Goodacre, S, Halladay, J, Hunt, H, Kintz, S, Lyssikatos, J, MacLeod, C, Ramiscal, S, Schmidt, S, Seward, E, Wiesmann, C, Williams, K, Wu, P, Yee, S, Yen, I, Malek, S. 登録日 2014-11-26 公開日 2015-06-03 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.86 Å) 主引用文献 Mitigation of Acetylcholine Esterase Activity in the 1,7-Diazacarbazole Series of Inhibitors of Checkpoint Kinase 1. J.Med.Chem., 58, 2015
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
4RG4	Epsilon-caprolactone-bound crystal structure of cyclohexanone monooxygenase in the Loose conformation 分子名称: Caprolactone, Cyclohexanone monooxygenase, FLAVIN-ADENINE DINUCLEOTIDE, ... 著者 Yachnin, B.J, Berghuis, A.M. 登録日 2014-09-29 公開日 2014-10-15 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.51 Å) 主引用文献 Lactone-bound structures of cyclohexanone monooxygenase provide insight into the stereochemistry of catalysis. Acs Chem.Biol., 9, 2014
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
4RL4	Crystal structure of GTP cyclohydrolase II from Helicobacter pylori 26695 分子名称: GTP cyclohydrolase-2, PYROPHOSPHATE 著者 Yadav, S, Karthikeyan, S. 登録日 2014-10-15 公開日 2015-08-26 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.199 Å) 主引用文献 Structural and biochemical characterization of GTP cyclohydrolase II from Helicobacter pylori reveals its redox dependent catalytic activity. J.Struct.Biol., 192, 2015
4RVL	CHK1 kinase domain with diazacarbazole compound 7: 3-(2-hydroxyphenyl)-9H-pyrrolo[2,3-b:5,4-c']dipyridine-6-carbonitrile 分子名称: 3-(2-hydroxyphenyl)-9H-pyrrolo[2,3-b:5,4-c']dipyridine-6-carbonitrile, Serine/threonine-protein kinase Chk1 著者 Wiesmann, C, Wu, P. 登録日 2014-11-26 公開日 2015-06-03 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Mitigation of Acetylcholine Esterase Activity in the 1,7-Diazacarbazole Series of Inhibitors of Checkpoint Kinase 1. J.Med.Chem., 58, 2015
1EER	CRYSTAL STRUCTURE OF HUMAN ERYTHROPOIETIN COMPLEXED TO ITS RECEPTOR AT 1.9 ANGSTROMS 分子名称: ERYTHROPOIETIN, ERYTHROPOIETIN RECEPTOR 著者 Syed, R.S, Li, C. 登録日 1998-07-24 公開日 1999-10-01 最終更新日 2021-11-03 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Efficiency of signalling through cytokine receptors depends critically on receptor orientation. Nature, 395, 1998
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
3MEN	Crystal structure of acetylpolyamine aminohydrolase from Burkholderia pseudomallei, iodide soak 分子名称: Acetylpolyamine aminohydrolase, IODIDE ION, POTASSIUM ION, ... 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2010-03-31 公開日 2010-04-21 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 SAD phasing using iodide ions in a high-throughput structural genomics environment. J Struct Funct Genomics, 12, 2011
5DVF	Crystal structure of unliganded periplasmic glucose binding protein (ppGBP) from P. putida CSV86 分子名称: Binding protein component of ABC sugar transporter, SULFATE ION 著者 Pandey, S, Modak, A, Phale, P.S, Bhaumik, P. 登録日 2015-09-21 公開日 2016-02-17 最終更新日 2016-04-27 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 High Resolution Structures of Periplasmic Glucose-binding Protein of Pseudomonas putida CSV86 Reveal Structural Basis of Its Substrate Specificity J.Biol.Chem., 291, 2016
4KSK	Gumby/Fam105B in complex with ubiquitin 分子名称: Polyubiquitin-C, Protein FAM105B, SULFATE ION 著者 Ceccarelli, D.F, Juang, Y.-C, Sicheri, F. 登録日 2013-05-17 公開日 2013-06-05 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 The linear ubiquitin-specific deubiquitinase gumby regulates angiogenesis. Nature, 498, 2013
5E67	K103A/K262A double mutant of I-SmaMI 分子名称: 2-(2-METHOXYETHOXY)ETHANOL, 2-METHOXYETHANOL, DNA bottom strand, ... 著者 Shen, B.W, Stoddard, B. 登録日 2015-10-09 公開日 2016-01-13 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 The Structural Basis of Asymmetry in DNA Binding and Cleavage as Exhibited by the I-SmaMI LAGLIDADG Meganuclease. J.Mol.Biol., 428, 2016
5EDK	Crystal structure of prothrombin deletion mutant residues 146-167 ( Form II ). 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, MAGNESIUM ION, ... 著者 Pozzi, N, Chen, Z, Di Cera, E. 登録日 2015-10-21 公開日 2016-01-20 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (3.214 Å) 主引用文献 How the Linker Connecting the Two Kringles Influences Activation and Conformational Plasticity of Prothrombin. J.Biol.Chem., 291, 2016
5E9R	X-ray structure of the complex between lysozyme and the compound fac, cis-[RuII(CO)3Cl2(N3-MBI), MBI=N-methyl-benzimidazole 分子名称: CARBON MONOXIDE, CHLORIDE ION, Lysozyme C, ... 著者 Merlino, A. 登録日 2015-10-15 公開日 2016-10-26 実験手法 X-RAY DIFFRACTION (2.25 Å) 主引用文献 {Ru(CO)x}-core Complexes with N-Methylbenzimidazole (MBI) and 5,6-Dimethylbenzimidazole (DMBI) as Possible Metal Based Drugs and CO Release Materials. Synthesis, X-ray Structure and Evaluation of Cytotoxic Activity against Human Cancer Cells To Be Published
6O6O	Structure of the regulator FasR from Mycobacterium tuberculosis 分子名称: MYRISTIC ACID, TetR family transcriptional regulator 著者 Larrieux, N, Trajtenberg, F, Lara, J, Gramajo, H, Buschiazzo, A. 登録日 2019-03-07 公開日 2020-03-11 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.63 Å) 主引用文献 Mycobacterium tuberculosis FasR senses long fatty acyl-CoA through a tunnel and a hydrophobic transmission spine. Nat Commun, 11, 2020
3M1L	Crystal structure of a C-terminal trunacted mutant of a putative ketoacyl reductase (FabG4) from Mycobacterium tuberculosis H37Rv at 2.5 Angstrom resolution 分子名称: 3-oxoacyl-(Acyl-carrier-protein) reductase, ACETATE ION 著者 Dutta, D, Bhattacharyya, S, Saha, B, Das, A.K. 登録日 2010-03-05 公開日 2010-12-22 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.52 Å) 主引用文献 Crystal structure of FabG4 from Mycobacterium tuberculosis reveals the importance of C-terminal residues in ketoreductase activity J.Struct.Biol., 174, 2011
6OGH	Structure of Aedes aegypti OBP22 in the complex with linoleic acid 分子名称: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, AAEL005772-PA, CADMIUM ION, ... 著者 Jones, D.N, Wang, J. 登録日 2019-04-02 公開日 2019-04-24 最終更新日 2020-05-06 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Aedes aegypti Odorant Binding Protein 22 selectively binds fatty acids through a conformational change in its C-terminal tail. Sci Rep, 10, 2020
5DW8	Crystal structure of 2'AMP bound SaIMPase-II 分子名称: ADENOSINE-2'-MONOPHOSPHATE, CALCIUM ION, GLYCEROL, ... 著者 Dutta, A, Bhattacharyya, S, Das, A.K. 登録日 2015-09-22 公開日 2015-12-09 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Crystal structure of 2'AMP bound SaIMPase-II To Be Published
6U18	Directed evolution of a biosensor selective for the macrolide antibiotic clarithromycin 分子名称: CITRATE ANION, CLARITHROMYCIN, Erythromycin resistance repressor protein 著者 Li, Y, Reed, M, Wright, H.T, Cropp, T.A, Williams, G. 登録日 2019-08-15 公開日 2020-08-19 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Development of Genetically Encoded Biosensors for Reporting the Methyltransferase-Dependent Biosynthesis of Semisynthetic Macrolide Antibiotics. Acs Synth Biol, 2021

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