PDB: 66507 件ウェブページステータス検索Chemie searchBIRD

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6AVD	Exploring Cystine Dense Peptide Space to Open a Unique Molecular Toolbox 分子名称: Potassium channel toxin alpha-KTx 6.9, SULFATE ION 著者 Gewe, M.M, Rupert, P, Strong, R.K. 登録日 2017-09-01 公開日 2018-02-28 最終更新日 2018-03-14 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Screening, large-scale production and structure-based classification of cystine-dense peptides. Nat. Struct. Mol. Biol., 25, 2018
6AXJ	Crystal structure of the Yaf9 YEATS domain bound to H3K27ac 分子名称: ALY-SER-ALA-PRO-ALA, GLYCEROL, Protein AF-9 homolog, ... 著者 Klein, B.J, Kutateladze, T.G. 登録日 2017-09-06 公開日 2017-11-22 最終更新日 2018-01-24 実験手法 X-RAY DIFFRACTION (2.379 Å) 主引用文献 Yaf9 subunit of the NuA4 and SWR1 complexes targets histone H3K27ac through its YEATS domain. Nucleic Acids Res., 46, 2018
7BI5	Human CA II in complex with benzyl alcohol 分子名称: Carbonic anhydrase 2, ZINC ION, phenylmethanol 著者 Alterio, V, De Simone, G. 登録日 2021-01-12 公開日 2021-03-17 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.74 Å) 主引用文献 Benzyl alcohol inhibits carbonic anhydrases by anchoring to the zinc coordinated water molecule. Biochem.Biophys.Res.Commun., 548, 2021
6AY8	Cartilage homing cysteine-dense-peptides 分子名称: Potassium channel toxin alpha-KTx 15.8, SULFATE ION 著者 Gewe, M.M, Strong, R.K, Watson, A. 登録日 2017-09-07 公開日 2018-08-22 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.78 Å) 主引用文献 Cartilage homing cysteine-dense-peptides To Be Published
4XZU	Crystal Structure of the Human Factor VIII C2 Domain in Complex with Murine 3E6 Inhibitory Antibody 分子名称: 3E6 antibody Fab heavy chain, 3E6 antibody Fab light chain, Coagulation factor VIII, ... 著者 Spiegel, P.C, Wuerth, M.E. 登録日 2015-02-05 公開日 2015-12-09 最終更新日 2019-12-04 実験手法 X-RAY DIFFRACTION (2.61 Å) 主引用文献 Structure of the Human Factor VIII C2 Domain in Complex with the 3E6 Inhibitory Antibody. Sci Rep, 5, 2015
6B5F	Crystal structure of nicotinate mononucleotide-5,6-dimethylbenzimidazole phosphoribosyltransferase CobT from Yersinia enterocolitica 分子名称: CHLORIDE ION, GLYCEROL, Nicotinate-nucleotide--dimethylbenzimidazole phosphoribosyltransferase, ... 著者 Stogios, P.J, Skarina, T, McChesney, C, Grimshaw, T, Savchenko, A, Anderson, W.F, Center for Structural Genomics of Infectious Diseases (CSGID) 登録日 2017-09-29 公開日 2017-10-18 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Crystal structure of nicotinate mononucleotide-5,6-dimethylbenzimidazole phosphoribosyltransferase CobT from Yersinia enterocolitica To Be Published
6B65	IMPase (AF2372) R92Q/K164E 分子名称: DI(HYDROXYETHYL)ETHER, Fructose-1,6-bisphosphatase/inositol-1-monophosphatase, ISOPROPYL ALCOHOL, ... 著者 Goldstein, R.I, Roberts, M. 登録日 2017-10-01 公開日 2018-10-03 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.702 Å) 主引用文献 Osmolyte binding capacity of a dual action IMPase/FBPase (AF2372) To Be Published
5CLU	THE CRYSTAL STRUCTURE OF THE COMPLEX of HCAII WITH A SACCHARINE DERIVATIVE 分子名称: (1,1-dioxido-3-oxo-1,2-benzothiazol-2(3H)-yl)acetic acid, Carbonic anhydrase 2, GLYCEROL, ... 著者 D'Ambrosio, K, De Simone, G. 登録日 2015-07-16 公開日 2015-11-11 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.55 Å) 主引用文献 A Combined Crystallographic and Theoretical Study Explains the Capability of Carboxylic Acids to Adopt Multiple Binding Modes in the Active Site of Carbonic Anhydrases. Chemistry, 22, 2016
6BTL	Crystal structure of Trypanothione Reductase from Trypanosoma brucei in complex with inhibitor RD117 1-[2-(Piperazin-1-yl)ethyl]-5-{5-[1-(pyrrolidin-1-yl)cyclohexyl]-1,3-thiazol-2-yl}-1H-indole 分子名称: 1-[2-(piperazin-1-yl)ethyl]-5-{5-[1-(pyrrolidin-1-yl)cyclohexyl]-1,3-thiazol-2-yl}-1H-indole, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, FLAVIN-ADENINE DINUCLEOTIDE, ... 著者 Bryson, S, De Gasparo, R, Krauth-Siegel, R.L, Diederich, F, Pai, E.F. 登録日 2017-12-06 公開日 2018-06-06 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.797 Å) 主引用文献 Biological Evaluation and X-ray Co-crystal Structures of Cyclohexylpyrrolidine Ligands for Trypanothione Reductase, an Enzyme from the Redox Metabolism of Trypanosoma. ChemMedChem, 13, 2018
5FCZ	Streptomyces plicatus N-acetyl-beta-hexosaminidase in complex with Thio-NAglucal (TNX) 分子名称: 1,5-anhydro-2-deoxy-2-(ethanethioylamino)-D-arabino-hex-1-enitol, B-N-acetylhexosaminidase, CHLORIDE ION, ... 著者 Vadlamani, G, Mark, B.L. 登録日 2015-12-15 公開日 2016-10-26 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.45 Å) 主引用文献 N-Acetyl glycals are tight-binding and environmentally insensitive inhibitors of hexosaminidases. Chem.Commun.(Camb.), 52, 2016
5CBK	Crystal structure of the strigolactone receptor ShHTL5 from Striga hermonthica 分子名称: 3,6,9,12,15,18,21,24,27,30,33,36,39-TRIDECAOXAHENTETRACONTANE-1,41-DIOL, CHLORIDE ION, MAGNESIUM ION, ... 著者 Stogios, P.J, Onopriyenko, O, Yim, V, Savchenko, A. 登録日 2015-07-01 公開日 2015-10-21 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.462 Å) 主引用文献 Structure-function analysis identifies highly sensitive strigolactone receptors in Striga. Science, 350, 2015
6C18	FGFR1 kinase complex with inhibitor SN37115 分子名称: 3-(2,6-dichloro-3,5-dimethoxyphenyl)-1-{(3S)-1-[(2E)-4-(dimethylamino)but-2-enoyl]pyrrolidin-3-yl}-7-[(propan-2-yl)amino]-3,4-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one, Fibroblast growth factor receptor 1, SULFATE ION 著者 Yosaatmadja, Y, Smaill, J.B, Squire, C.J. 登録日 2018-01-04 公開日 2019-01-16 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Understanding the structural requirements for covalent inhibition of FGFR1-3 To Be Published
4W1U	Crystal structure of Rv3557c/KstR2, a transcriptional repressor involved in cholesterol metabolism in Mycobacterium tuberculosis 分子名称: HTH-type transcriptional repressor KstR2 著者 Dawes, S.S, Kendall, S.K, Baker, E.N, Lott, J.S. 登録日 2014-08-13 公開日 2015-07-29 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.875 Å) 主引用文献 Crystal structure of Rv3557c/KstR2, a transcriptional repressor involved in cholesterol metabolism in Mycobacterium tuberculosis. To Be Published
7BTJ	Crystal structure of Pennisetum glaucum monodehydroascorbate reductase in complex with FADH2 分子名称: DIHYDROFLAVINE-ADENINE DINUCLEOTIDE, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, Pennisetum glaucum monodehydroascorbate reductase 著者 Sonkar, K.S, Achary, M.M, Reddy, M.K, Arulandu, A. 登録日 2020-04-01 公開日 2021-04-07 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (2.373 Å) 主引用文献 Crystal structure of Pennisetum glaucum monodehydroascorbate reductase To Be Published
5CGP	Selective pharmacological inhibition of the CREB binding protein bromodomain regulates inflammatory cytokines in macrophages and RGS4 in neurons 分子名称: 5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-methoxyphenyl)ethyl]-1-[2-(morpholin-4-yl)ethyl]-1H-benzimidazole, CREB-binding protein 著者 Chekler, E.L, Jones, L.H. 登録日 2015-07-09 公開日 2016-04-20 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.96 Å) 主引用文献 Transcriptional Profiling of a Selective CREB Binding Protein Bromodomain Inhibitor Highlights Therapeutic Opportunities. Chem.Biol., 22, 2015
7BUK	T1 lipase mutant - 5M (D43E/T118N/E226D/E250L/N304E) 分子名称: CALCIUM ION, Lipase, ZINC ION 著者 Ishak, S.N.H, Rahman, R.N.Z.R.A, Ali, M.S.M, Leow, A.T.C, Kamarudin, N.H.A. 登録日 2020-04-07 公開日 2021-04-07 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (2.644 Å) 主引用文献 Structure elucidation and docking analysis of 5M mutant of T1 lipase Geobacillus zalihae. Plos One, 16, 2021
2F15	Glycogen-Binding Domain Of The Amp-Activated Protein Kinase beta2 Subunit 分子名称: 5'-AMP-activated protein kinase, beta-2 subunit 著者 Walker, J.R, Wybenga-Groot, L, Finerty Jr, P.J, Newman, E, MacKenzie, F.M, Weigelt, J, Sundstrom, M, Arrowsmith, C, Edwards, A, Bochkarev, A, Dhe-Paganon, S, Structural Genomics Consortium (SGC) 登録日 2005-11-14 公開日 2005-12-27 最終更新日 2023-08-23 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Structure of the Glycogen-Binding Domain Of The Amp-Activated Protein Kinase beta2 Subunit To be Published
7BUZ	Crystal structure of Pennisetum glaucum monodehydroascorbate reductase 分子名称: FLAVIN-ADENINE DINUCLEOTIDE, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, Pennisetum glaucum monodehydroascorbate reductase 著者 Sonkar, K.S, Arulandu, A, Achary, M.M, Reddy, M.K. 登録日 2020-04-08 公開日 2021-04-14 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (2.288 Å) 主引用文献 Crystal structure of Pennisetum glaucum monodehydroascorbate reductase To Be Published
8B7Z	Bacterial chalcone isomerase H33A with taxifolin 分子名称: (2R,3R)-2-(3,4-DIHYDROXYPHENYL)-3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H-CHROMEN-4-ONE, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CHLORIDE ION, ... 著者 Palm, G.J, Hinrichs, W. 登録日 2022-10-03 公開日 2022-11-23 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 Structural Basis for (2 R ,3 R )-Taxifolin Binding and Reaction Products to the Bacterial Chalcone Isomerase of Eubacterium ramulus . Molecules, 27, 2022
4ZN7	Crystal Structure of the ER-alpha Ligand-binding Domain (Y537S) in complex with Diethylstilbestrol 分子名称: DIETHYLSTILBESTROL, Estrogen receptor, Nuclear receptor coactivator 2 著者 Nwachukwu, J.C, Srinivasan, S, Zheng, Y, Wang, S, Min, J, Dong, C, Liao, Z, Cavett, V, Nowak, J, Houtman, R, Carlson, K.E, Josan, J.S, Elemento, O, Katzenellenbogen, J.A, Zhou, H.B, Nettles, K.W. 登録日 2015-05-04 公開日 2016-05-04 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.934 Å) 主引用文献 Predictive features of ligand-specific signaling through the estrogen receptor. Mol.Syst.Biol., 12, 2016
7A13	CRYSTAL STRUCTURE OF HUMAN METHIONINE AMINOPEPTIDASE-2 IN COMPLEX WITH AN INHIBITOR GSK1978537A (COMPOUND 27) 分子名称: 5-chloranyl-3-(3-methoxyphenyl)-1~{H}-indole-2-carboxamide, MANGANESE (II) ION, Methionine aminopeptidase 2, ... 著者 Thorpe, J.H. 登録日 2020-08-11 公開日 2020-09-23 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (2.04 Å) 主引用文献 Structure-based optimisation of orally active & reversible MetAP-2 inhibitors maintaining a tight 'molecular budget'. Bioorg.Med.Chem.Lett., 30, 2020
4YXZ	Computationally designed left-handed alpha/alpha toroid with 9 repeats 分子名称: dTor_9x31L 著者 Doyle, L, Stoddard, B.L, Bradley, P. 登録日 2015-03-23 公開日 2015-12-16 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (2.496 Å) 主引用文献 Rational design of alpha-helical tandem repeat proteins with closed architectures. Nature, 528, 2015
6ZS8	X-ray structure of the adduct formed upon treating lysozyme with an aged solution of arsenoplatin-1 分子名称: 1,2-ETHANEDIOL, DIMETHYL SULFOXIDE, Lysozyme, ... 著者 Ferraro, G, Merlino, A. 登録日 2020-07-15 公開日 2020-12-23 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (2.153 Å) 主引用文献 The first step of arsenoplatin-1 aggregation in solution unveiled by solving the crystal structure of its protein adduct. Dalton Trans, 50, 2021
7AN5	Enzyme of biosynthetic pathway 分子名称: 3-[(1-Carboxyvinyl)oxy]benzoic acid, Chorismate dehydratase 著者 Archna, A, Breithaupt, C, Stubbs, M.T. 登録日 2020-10-11 公開日 2022-04-20 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.91 Å) 主引用文献 Mechanism of chorismate dehydratase MqnA, the first enzyme of the futalosine pathway, proceeds via substrate-assisted catalysis J.Biol.Chem., 2022
7AN6	Enzyme of biosynthetic pathway 分子名称: (3R,4R)-3-[(1-carboxyethenyl)oxy]-4-hydroxycyclohexa-1,5-diene-1-carboxylic acid, Chorismate dehydratase, GLYCEROL 著者 Archna, A, Breithaupt, C, Stubbs, M.T. 登録日 2020-10-11 公開日 2022-04-20 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.91 Å) 主引用文献 Mechanism of chorismate dehydratase MqnA, the first enzyme of the futalosine pathway, proceeds via substrate-assisted catalysis J.Biol.Chem., 2022

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