PDB: 30476 件ウェブページステータス検索Chemie searchBIRD

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6S52	The crystal structure of glycogen phosphorylase in complex with 14 分子名称: (2~{R},3~{S},4~{S},5~{R},6~{R})-2-(hydroxymethyl)-6-(5-phenyl-1,2,3,4-tetrazol-2-yl)oxane-3,4,5-triol, Glycogen phosphorylase, muscle form, ... 著者 Kyriakis, E, Solovou, T.G.A, Papaioannou, O.S.E, Skamnaki, V.T, Leonidas, D.D. 登録日 2019-06-29 公開日 2020-02-19 実験手法 X-RAY DIFFRACTION (2.37 Å) 主引用文献 The architecture of hydrogen and sulfur sigma-hole interactions explain differences in the inhibitory potency of C-beta-d-glucopyranosyl thiazoles, imidazoles and an N-beta-d glucopyranosyl tetrazole for human liver glycogen phosphorylase and offer new insights to structure-based design. Bioorg.Med.Chem., 28, 2020
6S6G	Crystal Structure of the Homospermidine Synthase (HSS) variant E117Q from Blastochloris viridis in Complex with NAD 分子名称: 3-PYRIDINIUM-1-YLPROPANE-1-SULFONATE, Homospermidine synthase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... 著者 Helfrich, F, Scheidig, A.J. 登録日 2019-07-03 公開日 2020-07-15 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Structural and catalytic characterization of Blastochloris viridis and Pseudomonas aeruginosa homospermidine synthases supports the essential role of cation-pi interaction. Acta Crystallogr D Struct Biol, 77, 2021
6RJL	Fragment AZ-018 binding at the TAZpS89/14-3-3 sigma interface 分子名称: 14-3-3 protein sigma, 5-(3-azanylpropyl)-4-phenyl-thiophene-2-carboximidamide, TAZpS89 著者 Genet, S, Wolter, M, Guillory, X, Somsen, B, Leysen, S, Patel, J, Castaldi, P, Ottmann, C. 登録日 2019-04-27 公開日 2020-06-17 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.28 Å) 主引用文献 Fragment-based Differential Targeting of PPI Stabilizer Interfaces. J.Med.Chem., 63, 2020
6RKA	Inter-dimeric interface controls function and stability of S-methionine adenosyltransferase from U. urealiticum 分子名称: ADENOSINE-5'-TRIPHOSPHATE, Methionine adenosyltransferase, PHOSPHATE ION, ... 著者 Shahar, A, Zarivach, R, Bershtein, S, Kleiner, D, Shmulevich, F. 登録日 2019-04-30 公開日 2019-09-25 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 The interdimeric interface controls function and stability of Ureaplasma urealiticum methionine S-adenosyltransferase. J.Mol.Biol., 431, 2019
6RKY	STRUCTURE OF ESTER-HYDROLASE EH1AB1 FROM THE METAGENOME OF LAKE ARREO COMPLEXED WITH A DERIVATIVE OF BIPYRIDINE PHOSPHONATE 分子名称: DI(HYDROXYETHYL)ETHER, EH1AB1, GLYCEROL, ... 著者 Cea-Rama, I, Sanz-Aparicio, J. 登録日 2019-04-30 公開日 2019-12-25 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (2.79 Å) 主引用文献 Genetically engineered proteins with two active sites for enhanced biocatalysis and synergistic chemo- and biocatalysis Nat Catal, 3, 2020
6RLC	Crystal structure of the PDZ tandem of syntenin in complex with fragment F13 分子名称: (2~{S})-2-[3-(4-chlorophenyl)sulfanylpropanoylamino]-3-methyl-butanoic acid, ACETATE ION, Syntenin-1 著者 Feracci, M, Barral, K. 登録日 2019-05-02 公開日 2021-02-03 最終更新日 2024-05-15 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Pharmacological inhibition of syntenin PDZ2 domain impairs breast cancer cell activities and exosome loadifing with syndecan and EpCAM cargo. J Extracell Vesicles, 10, 2020
6S30	Crystal Structure of Seryl-tRNA Synthetase from Klebsiella pneumoniae 分子名称: 1,2-ETHANEDIOL, CALCIUM ION, Serine--tRNA ligase 著者 Pang, L, De Graef, S, Weeks, S.D, Strelkov, S.V. 登録日 2019-06-23 公開日 2020-01-08 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.41 Å) 主引用文献 Structural Insights into the Binding of Natural Pyrimidine-Based Inhibitors of Class II Aminoacyl-tRNA Synthetases. Acs Chem.Biol., 15, 2020
6RM7	Fragment AZ-026 binding at the p53pT387/14-3-3 sigma interface 分子名称: 14-3-3 protein sigma, 5-[3-(2-azanylethyl)imidazol-4-yl]-4-phenyl-thiophene-2-carboximidamide, CHLORIDE ION, ... 著者 Somsen, B, Wolter, M, Guillory, X, Genet, S, Leysen, S, Patel, J, Castaldi, P, Ottmann, C. 登録日 2019-05-05 公開日 2020-06-17 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Fragment-based Differential Targeting of PPI Stabilizer Interfaces. J.Med.Chem., 63, 2020
6RMF	Crystal structure of NDM-1 with VNRX-5133 分子名称: (10aR)-2-(((1r,4R)-4-((2-aminoethyl)amino)cyclohexyl)methyl)-6-carboxy-4-hydroxy-4,10a-dihydro-10H-benzo[5,6][1,2]oxaborinino[2,3-b][1,4,2]oxazaborol-4-uide, (4~{R})-4-[2-[4-(2-azanylethylamino)cyclohexyl]ethanoylamino]-3,3-bis(oxidanyl)-2-oxa-3-boranuidabicyclo[4.4.0]deca-1(10),6,8-triene-10-carboxylic acid, Metallo-beta-lactamase type 2, ... 著者 Hinchliffe, P, Spencer, J, Brem, J, Schofield, C.J. 登録日 2019-05-06 公開日 2019-09-11 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.51 Å) 主引用文献 Bicyclic Boronate VNRX-5133 Inhibits Metallo- and Serine-beta-Lactamases. J.Med.Chem., 62, 2019
6S46	Room temperature structure of the LOV2 domain of phototropin-2 from Arabidopsis thaliana 4158 ms after initiation of illumination, determined with a serial crystallography approach 分子名称: FLAVIN MONONUCLEOTIDE, Phototropin-2 著者 Aumonier, S, Santoni, G, Gotthard, G, von Stetten, D, Leonard, G, Royant, A. 登録日 2019-06-26 公開日 2020-07-08 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.75 Å) 主引用文献 Millisecond time-resolved serial oscillation crystallography of a blue-light photoreceptor at a synchrotron. Iucrj, 7, 2020
6RMT	Crystal structure of disulphide-linked human C3d dimer 分子名称: CHLORIDE ION, Complement C3 著者 Wahid, A.A, van den Elsen, J.M.H, Crennell, S.J. 登録日 2019-05-07 公開日 2020-11-18 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Insights Into the Structure-Function Relationships of Dimeric C3d Fragments. Front Immunol, 12, 2021
6S5Y	Structure of tandemly arrayed consecutive Rib domains (Rib2R) from Group B Streptococcal species Streptococcus agalactiae 分子名称: Group B streptococcal R4 surface protein 著者 Whelan, F, Griffiths, S.C, Bateman, A, Potts, J.R. 登録日 2019-07-02 公開日 2019-12-11 最終更新日 2024-06-19 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Defining the remarkable structural malleability of a bacterial surface protein Rib domain implicated in infection. Proc.Natl.Acad.Sci.USA, 116, 2019
6S74	Crystal structure of CARM1 in complex with inhibitor UM305 分子名称: (2~{R},3~{R},4~{S},5~{R})-2-(6-aminopurin-9-yl)-5-[[3-azanylpropyl-[3-(pyrimidin-2-ylamino)propyl]amino]methyl]oxolane-3,4-diol, GLYCEROL, Histone-arginine methyltransferase CARM1 著者 Gunnell, E.A, Muhsen, U, Dowden, J, Dreveny, I. 登録日 2019-07-04 公開日 2020-03-04 最終更新日 2024-05-15 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Structural and biochemical evaluation of bisubstrate inhibitors of protein arginine N-methyltransferases PRMT1 and CARM1 (PRMT4). Biochem.J., 477, 2020
6RP1	1.49 A RESOLUTION OF SPOROSARCINA PASTEURII UREASE INHIBITED IN THE PRESENCE OF NBPTO AT pH 6.5 分子名称: 1,2-ETHANEDIOL, DIAMIDOPHOSPHATE, NICKEL (II) ION, ... 著者 Mazzei, L, Cianci, M, Benini, S, Ciurli, S. 登録日 2019-05-13 公開日 2020-03-11 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.49 Å) 主引用文献 The Impact of pH on Catalytically Critical Protein Conformational Changes: The Case of the Urease, a Nickel Enzyme. Chemistry, 25, 2019
6S7E	Plant Cysteine Oxidase PCO4 from Arabidopsis thaliana (using PEG 3350 and NaF as precipitants) 分子名称: FE (III) ION, Plant cysteine oxidase 4 著者 White, M.D, Levy, C.W, Flashman, E, McDonough, M.A. 登録日 2019-07-04 公開日 2020-07-22 最終更新日 2024-05-15 実験手法 X-RAY DIFFRACTION (1.82 Å) 主引用文献 Structures of Arabidopsis thaliana oxygen-sensing plant cysteine oxidases 4 and 5 enable targeted manipulation of their activity. Proc.Natl.Acad.Sci.USA, 117, 2020
6S7H	Human CD73 (5'-nucleotidase) in complex with PSB12489 (an AOPCP derivative) in the closed state 分子名称: (N6,N6)-methyl,benzyl-C2-chloro-(alpha,beta)-methylene-ADP, 5'-nucleotidase, CALCIUM ION, ... 著者 Pippel, J, Strater, N. 登録日 2019-07-04 公開日 2020-07-22 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 X-Ray Co-Crystal Structure Guides the Way to Subnanomolar Competitive Ecto-5'-Nucleotidase (CD73) Inhibitors for Cancer Immunotherapy Adv Ther, 2019
6RR5	Structure of 50% reduced KpDyP 分子名称: GLYCEROL, Iron-dependent peroxidase, MAGNESIUM ION, ... 著者 Pfanzagl, V, Beale, J, Hofbauer, S. 登録日 2019-05-17 公開日 2020-09-02 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 X-ray-induced photoreduction of heme metal centers rapidly induces active-site perturbations in a protein-independent manner. J.Biol.Chem., 295, 2020
6RS1	Dipeptide Gly-Pro binds to a glycolytic enzyme fructose bisphosphate aldolase 分子名称: Fructose-bisphosphate aldolase 6, cytosolic, SULFATE ION 著者 Shahar, A, Zarivach, R, Skirycz, A, Wojciechowska, I. 登録日 2019-05-21 公開日 2020-04-01 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Dipeptide Gly-Pro binds to a glycolytic enzyme fructose bisphosphate aldolase To Be Published
6S87	Crystal structure of 2-methylcitrate synthase (PrpC) from Pseudomonas aeruginosa in complex with oxaloacetate. 分子名称: Citrate synthase, GLYCEROL, OXALOACETATE ION 著者 Wijaya, A.J, Brear, P, Dolan, S.K, Welch, M. 登録日 2019-07-08 公開日 2020-10-21 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Crystal structure of 2-methylcitrate synthase (PrpC) from Pseudomonas aeruginosa in complex with oxaloacetate. To Be Published
6RT1	Native tetragonal lysozyme - home source data 分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Lysozyme C, ... 著者 Pereira, P.J.B. 登録日 2019-05-22 公開日 2019-05-29 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.336 Å) 主引用文献 Protein crystals as a key for deciphering macromolecular crowding effects on biological reactions. Phys Chem Chem Phys, 22, 2020
6RFK	Crystal structure of EGRCK-inhibited Gla-domainless fIXa (K148Q, R150Q variant) 分子名称: 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CALCIUM ION, Coagulation factor IX, ... 著者 Huntington, J.A, Sendall, T.J. 登録日 2019-04-15 公開日 2019-06-12 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 NMR resonance assignments of apo and EGRCK-inhibited factor IXa To Be Published
6RGE	Crystal structure of NAD kinase 1 from Listeria monocytogenes in complex with an inhibitor 分子名称: CITRIC ACID, NAD kinase 1, [(2~{R},3~{R},4~{R},5~{R})-2-[8-[3-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]prop-1-ynyl]-6-azanyl-purin-9-yl]-5-(hydroxymethyl)-4-oxidanyl-oxolan-3-yl] dihydrogen phosphate 著者 Gelin, M, Labesse, G. 登録日 2019-04-16 公開日 2020-05-13 最終更新日 2024-05-15 実験手法 X-RAY DIFFRACTION (1.801 Å) 主引用文献 Crystal structure of NAD kinase 1 from Listeria monocytogenes in complex with an inhibitor To Be Published
6RLW	Structure of the human 8-oxoguanine DNA Glycosylase hOGG1 in complex with inhibitor TH5487 分子名称: 4-(4-bromanyl-2-oxidanylidene-3~{H}-benzimidazol-1-yl)-~{N}-(4-iodophenyl)piperidine-1-carboxamide, N-glycosylase/DNA lyase 著者 Masuyer, G, Stenmark, P. 登録日 2019-05-03 公開日 2020-07-22 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Targeting OGG1 arrests cancer cell proliferation by inducing replication stress. Nucleic Acids Res., 48, 2020
6RFV	Revisiting pH-gated conformational switch. Complex HK853-RR468 pH 7 分子名称: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, Response regulator, ... 著者 Mideros-Mora, C, Casino, P, Marina, A. 登録日 2019-04-16 公開日 2020-02-19 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.83 Å) 主引用文献 Revisiting the pH-gated conformational switch on the activities of HisKA-family histidine kinases. Nat Commun, 11, 2020
6RMJ	Crystal structure of human NGR-TNF 分子名称: Tumor necrosis factor 著者 Degano, M, Garau, G. 登録日 2019-05-07 公開日 2019-10-09 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.65 Å) 主引用文献 Mechanism of Action of the Tumor Vessel Targeting Agent NGR-hTNF: Role of Both NGR Peptide and hTNF in Cell Binding and Signaling. Int J Mol Sci, 20, 2019

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