PDB: 223790 件ウェブページステータス検索Chemie searchBIRD

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4IH6	Hepatitis C Virus polymerase NS5B (BK) with fragment-based compounds 分子名称: (5S)-3-(4-tert-butylbenzyl)-5-(propan-2-yl)imidazolidine-2,4-dione, RNA-directed RNA polymerase 著者 Harris, S.F, Wong, A. 登録日 2012-12-18 公開日 2013-07-03 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 De novo fragment design: a medicinal chemistry approach to fragment-based lead generation. J.Med.Chem., 56, 2013
3P39	Crystal structure of the NS1 effector domain W182A mutant from influenza A/Vietnam/1203/2004 (H5N1) virus 分子名称: Nonstructural protein 1 著者 Chen, S, Xiao, Y.B, Bricogne, G, Sharff, A.J, Hilgenfeld, R. 登録日 2010-10-04 公開日 2011-10-05 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (3.14 Å) 主引用文献 X-ray structures of the NS1 effector domain from highly pathogenic influenza A/Vietnam/1203/2004 (H5N1) virus To be Published
4IKH	Crystal structure of a glutathione transferase family member from Pseudomonas fluorescens pf-5, target efi-900003, with two glutathione bound 分子名称: CHLORIDE ION, GLUTATHIONE, Glutathione S-transferase 著者 Vetting, M.W, Sauder, J.M, Morisco, L.L, Wasserman, S.R, Sojitra, S, Imker, H.J, Burley, S.K, Armstrong, R.N, Gerlt, J.A, Almo, S.C, Enzyme Function Initiative (EFI) 登録日 2012-12-26 公開日 2013-01-16 最終更新日 2021-02-10 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Crystal structure of a glutathione transferase family member from Pseudomonas fluorescens pf-5, target efi-900003, with two glutathione bound To be Published
4IL6	Structure of Sr-substituted photosystem II 分子名称: 1,2-DI-O-ACYL-3-O-[6-DEOXY-6-SULFO-ALPHA-D-GLUCOPYRANOSYL]-SN-GLYCEROL, 1,2-DIPALMITOYL-PHOSPHATIDYL-GLYCEROLE, 1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDE, ... 著者 Koua, F.H.M, Umena, Y, Kawakami, K, Kamiya, N, Shen, J.R. 登録日 2012-12-29 公開日 2013-03-06 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Structure of Sr-substituted photosystem II at 2.1 A resolution and its implications in the mechanism of water oxidation Proc.Natl.Acad.Sci.USA, 110, 2013
4IK7	Crystal structure of human transthyretin in complex with indomethacin 分子名称: INDOMETHACIN, Transthyretin 著者 Lima, L.M.T.R. 登録日 2012-12-25 公開日 2013-01-30 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Crystal structure of human transthyretin in complex with indomethacin To be Published
4IKV	Crystal structure of peptide transporter POT 分子名称: (2S)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate, Di-tripeptide ABC transporter (Permease), OLEIC ACID, ... 著者 Doki, S, Kato, H.E, Ishitani, R, Nureki, O. 登録日 2012-12-28 公開日 2013-07-10 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structural basis for dynamic mechanism of proton-coupled symport by the peptide transporter POT. Proc.Natl.Acad.Sci.USA, 110, 2013
4IH7	Hepatitis C Virus polymerase NS5B (BK) with fragment-based compounds 分子名称: 3-(3-tert-butylphenyl)pyridin-2(1H)-one, RNA-directed RNA polymerase, ZINC ION 著者 Harris, S.F, Wong, A. 登録日 2012-12-18 公開日 2013-07-03 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 De novo fragment design: a medicinal chemistry approach to fragment-based lead generation. J.Med.Chem., 56, 2013
4IDB	Structure of the Fragaria x ananassa enone oxidoreductase in complex with NADP+ 分子名称: 1,2-ETHANEDIOL, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Ripening-induced protein, ... 著者 Schiefner, A, Skerra, A. 登録日 2012-12-12 公開日 2013-04-17 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.55 Å) 主引用文献 Structural basis for the enzymatic formation of the key strawberry flavor compound 4-hydroxy-2,5-dimethyl-3(2H)-furanone J.Biol.Chem., 288, 2013
4IHL	Human 14-3-3 isoform zeta in complex with a diphoyphorylated C-RAF peptide and Cotylenin A 分子名称: (1R,3aS,4R,5R,6R,9aR,10E)-6-({(1S,2R,4S,5R,6R,8S,9S)-5-hydroxy-2-(methoxymethyl)-9-methyl-9-[(2S)-oxiran-2-yl]-3,7,10,1 1-tetraoxatricyclo[6.2.1.0~1,6~]undec-4-yl}oxy)-1-(methoxymethyl)-4,9a-dimethyl-7-(propan-2-yl)-1,2,3,3a,4,5,6,8,9,9a-de cahydrodicyclopenta[a,d][8]annulene-1,5-diol, 14-3-3 protein zeta/delta, POTASSIUM ION, ... 著者 Molzan, M, Ottmann, C. 登録日 2012-12-19 公開日 2013-09-25 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Stabilization of Physical RAF/14-3-3 Interaction by Cotylenin A as Treatment Strategy for RAS Mutant Cancers. Acs Chem.Biol., 8, 2013
4IIM	Crystal structure of the Second SH3 Domain of ITSN1 bound with a synthetic peptide 分子名称: Intersectin-1, UNKNOWN ATOM OR ION, peptide ligand 著者 Dong, A, Guan, X, Huang, H, Wernimont, A, Gu, J, Sidhu, S, Bountra, C, Arrowsmith, C.H, Edwards, A.M, Tong, Y, Structural Genomics Consortium (SGC) 登録日 2012-12-20 公開日 2013-01-23 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Crystal structure of the Second SH3 Domain of ITSN1 bound with a synthetic peptide To be Published
4IIN	Crystal structure of a putative 3-oxoacyl-[acyl-carrier protein]reductase from Helicobacter pylori 26695 complexed with NAD+ 分子名称: 3-ketoacyl-acyl carrier protein reductase (FabG), ACETATE ION, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... 著者 Hou, J, Osinski, T, Zheng, H, Shumilin, I, Shabalin, I, Shatsman, S, Anderson, W.F, Minor, W, Center for Structural Genomics of Infectious Diseases (CSGID) 登録日 2012-12-20 公開日 2013-01-09 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Crystal structure of a putative 3-oxoacyl-[acyl-carrier protein]reductase from Helicobacter pylori 26695 complexed with NAD+ To be Published
4IFT	Crystal structure of double mutant thermostable NPPase from Geobacillus stearothermophilus 分子名称: Thermostable NPPase 著者 Guo, Z, Huang, J, Wang, F, Qiu, R, Wang, Y, Ji, C. 登録日 2012-12-15 公開日 2013-12-18 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.995 Å) 主引用文献 Crystal structure of thermostable NPPase from Geobacillus stearothermophilus To be Published
3OWC	Crystal structure of GNAT superfamily protein PA2578 from Pseudomonas aeruginosa 分子名称: 1,2-ETHANEDIOL, COENZYME A, Probable acetyltransferase 著者 Majorek, K.A, Chruszcz, M, Joachimiak, A, Minor, W, Midwest Center for Structural Genomics (MCSG) 登録日 2010-09-17 公開日 2010-11-03 最終更新日 2022-04-13 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Crystal structure of GNAT superfamily protein PA2578 from Pseudomonas aeruginosa To be Published
4IG1	Crystal structure of Treponema pallidum TP0796 Flavin trafficking protein, Mg(II)-AMP product bound form 分子名称: ACETATE ION, ADENOSINE MONOPHOSPHATE, FAD:protein FMN transferase, ... 著者 Tomchick, D.R, Brautigam, C.A, Deka, R.K, Norgard, M.V. 登録日 2012-12-15 公開日 2013-02-27 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.4318 Å) 主引用文献 The TP0796 Lipoprotein of Treponema pallidum Is a Bimetal-dependent FAD Pyrophosphatase with a Potential Role in Flavin Homeostasis. J.Biol.Chem., 288, 2013
4IJF	Crystal structure of the Zaire ebolavirus VP35 interferon inhibitory domain K222A/R225A/K248A/K251A mutant 分子名称: Polymerase cofactor VP35 著者 Binning, J.B, Wang, T, Leung, D.W, Xu, W, Borek, D, Amarasinghe, G.K. 登録日 2012-12-21 公開日 2013-10-09 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.506 Å) 主引用文献 Development of RNA Aptamers Targeting Ebola Virus VP35. Biochemistry, 52, 2013
3OXA	Crystal Structure of Ketosteroid Isomerase D40N/C69S/C81S/C97S/M116C-CN from P. putida 分子名称: Steroid Delta-isomerase 著者 Sigala, P.A, Fenn, T.D, Herschlag, D. 登録日 2010-09-21 公開日 2011-09-21 最終更新日 2023-12-06 実験手法 X-RAY DIFFRACTION (1.89 Å) 主引用文献 Quantitative, directional measurement of electric field heterogeneity in the active site of ketosteroid isomerase. Proc.Natl.Acad.Sci.USA, 109, 2012
4IL5	Crystal structure of O-Acetyl Serine Sulfhydrylase from Entamoeba histolytica in complex with isoleucine 分子名称: Cysteine synthase, ISOLEUCINE, SULFATE ION 著者 Raj, I, Gourinath, S. 登録日 2012-12-29 公開日 2013-12-04 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.03 Å) 主引用文献 Molecular basis of ligand recognition by OASS from E. histolytica: insights from structural and molecular dynamics simulation studies Biochim.Biophys.Acta, 1830, 2013
4IBY	Human p53 core domain with hot spot mutation R273H and second-site suppressor mutation S240R 分子名称: 1,2-ETHANEDIOL, Cellular tumor antigen p53, ZINC ION 著者 Eldar, A, Rozenberg, H, Diskin-Posner, Y, Shakked, Z. 登録日 2012-12-09 公開日 2013-08-14 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 Structural studies of p53 inactivation by DNA-contact mutations and its rescue by suppressor mutations via alternative protein-DNA interactions. Nucleic Acids Res., 41, 2013
3OXL	Human lysine methyltransferase Smyd3 in complex with AdoHcy (Form II) 分子名称: S-ADENOSYL-L-HOMOCYSTEINE, SET and MYND domain-containing protein 3, ZINC ION 著者 Xu, S, Wu, J, Sun, B, Zhong, C, Ding, J. 登録日 2010-09-21 公開日 2011-02-23 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (3.6 Å) 主引用文献 Structural and biochemical studies of human lysine methyltransferase Smyd3 reveal the important functional roles of its post-SET and TPR domains and the regulation of its activity by DNA binding Nucleic Acids Res., 39, 2011
4IMF	Crystal Structure of Pasteurella multocida N-Acetyl-D-Neuraminic acid lyase K164 mutant complexed with N-Acetylneuraminic acid 分子名称: 1-ETHOXY-2-(2-METHOXYETHOXY)ETHANE, 5-(acetylamino)-3,5-dideoxy-D-glycero-D-galacto-non-2-ulosonic acid, CHLORIDE ION, ... 著者 Fisher, A.J, Huynh, N. 登録日 2013-01-02 公開日 2013-11-06 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structural Basis for Substrate Specificity and Mechanism of N-Acetyl-d-neuraminic Acid Lyase from Pasteurella multocida. Biochemistry, 52, 2013
4IDG	Crystal structure of a short-chain dehydrogenase/reductase superfamily protein from agrobacterium tumefaciens (TARGET EFI-506441) with bound NAD, monoclinic form 2 分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... 著者 Vetting, M.W, Groninger-Poe, F, Morisco, L.L, Wasserman, S.R, Sojitra, S, Imker, H.J, Gerlt, J.A, Almo, S.C, Enzyme Function Initiative (EFI) 登録日 2012-12-12 公開日 2012-12-26 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Crystal structure of a short-chain dehydrogenase/reductase superfamily protein from agrobacterium tumefaciens (TARGET EFI-506441) with bound NAD, monoclinic form 2 To be Published
1XI8	Molybdenum cofactor biosynthesis protein from Pyrococcus furiosus Pfu-1657500-001 分子名称: Molybdenum cofactor biosynthesis protein 著者 Zhou, W, Zhao, M, Chang, J.C, Liu, Z.-J, Chen, L, Horanyi, P, Xu, H, Yang, H, Habel, J.E, Lee, D, Chang, S.-H, Rose, J.P, Wang, B.-C, Southeast Collaboratory for Structural Genomics (SECSG) 登録日 2004-09-21 公開日 2004-11-30 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (2.504 Å) 主引用文献 Molybdenum cofactor biosynthesis protein from Pyrococcus furiosus Pfu-1657500-001 To be published
4IN6	(M)L214A mutant of the Rhodobacter sphaeroides Reaction Center 分子名称: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, BACTERIOCHLOROPHYLL A, BACTERIOPHEOPHYTIN A, ... 著者 Saer, R.G, Hardjasa, A, Murphy, M.E.P, Beatty, J.T. 登録日 2013-01-04 公開日 2013-05-01 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Role of Rhodobacter sphaeroides Photosynthetic Reaction Center Residue M214 in the Composition, Absorbance Properties, and Conformations of HA and BA Cofactors. Biochemistry, 52, 2013
4IFZ	Crystal structure of Treponema pallidum TP0796 Flavin trafficking protein, Mn(II)-AMP product bound form 分子名称: ADENOSINE MONOPHOSPHATE, MAGNESIUM ION, MANGANESE (II) ION, ... 著者 Tomchick, D.R, Brautigam, C.A, Deka, R.K, Norgard, M.V. 登録日 2012-12-15 公開日 2013-02-27 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.9012 Å) 主引用文献 The TP0796 Lipoprotein of Treponema pallidum Is a Bimetal-dependent FAD Pyrophosphatase with a Potential Role in Flavin Homeostasis. J.Biol.Chem., 288, 2013
4IGR	Crystal structure of the kainate receptor GluK3 ligand-binding domain in complex with the agonist ZA302 分子名称: (4R)-4-{3-[hydroxy(methyl)amino]-3-oxopropyl}-L-glutamic acid, CHLORIDE ION, Glutamate receptor, ... 著者 Larsen, A.P, Venskutonyte, R, Gajhede, M, Kastrup, J.S, Frydenvang, K. 登録日 2012-12-18 公開日 2013-03-06 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.65 Å) 主引用文献 Chemoenzymatic synthesis of new 2,4-syn-functionalized (S)-glutamate analogues and structure-activity relationship studies at ionotropic glutamate receptors and excitatory amino acid transporters. J.Med.Chem., 56, 2013

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