PDB: 45459 件ウェブページステータス検索Chemie searchBIRD

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5KYV	Structure of Photinus pyralis Luciferase green shifted light emitting variant 分子名称: 5'-O-[N-(DEHYDROLUCIFERYL)-SULFAMOYL] ADENOSINE, L(+)-TARTARIC ACID, Luciferin 4-monooxygenase 著者 Gulick, A.M. 登録日 2016-07-22 公開日 2016-12-21 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Cloning of the Orange Light-Producing Luciferase from Photinus scintillans Provides Insight into Bioluminescence Color Determination To Be Published
6Q8P	Structure of CLK1 with bound N-methyl-10-nitropyrido[3,4-g]quinazolin-2-amine 分子名称: Dual specificity protein kinase CLK1, POTASSIUM ION, ~{N}-methyl-10-nitro-pyrido[3,4-g]quinazolin-2-amine 著者 Joerger, A.C, Chatterjee, D, Schroeder, M, Tazarki, H, Zeinyeh, W, Esvan, Y.J, Khiari, J, Josselin, B, Baratte, B, Bach, S, Ruchaud, S, Anizon, F, Giraud, F, Moreau, P, Knapp, S, Structural Genomics Consortium (SGC) 登録日 2018-12-15 公開日 2019-02-20 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 New pyrido[3,4-g]quinazoline derivatives as CLK1 and DYRK1A inhibitors: synthesis, biological evaluation and binding mode analysis. Eur J Med Chem, 166, 2019
6FOQ	The crystal structure of EncM complexed with dioxygen under 15 bar of oxygen pressure. 分子名称: FLAVIN-ADENINE DINUCLEOTIDE, OXYGEN MOLECULE, Putative FAD-dependent oxygenase EncM 著者 Saleem-Batcha, R, Teufel, R. 登録日 2018-02-08 公開日 2018-05-02 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.386 Å) 主引用文献 Enzymatic control of dioxygen binding and functionalization of the flavin cofactor. Proc. Natl. Acad. Sci. U.S.A., 115, 2018
6CJZ	Solution Structure of Amebosin 分子名称: Amoebiasin-1 著者 Mendoza, A, Flores-Solis, D, Del Rio Portilla, F, Brieba de Castro, L. 登録日 2018-02-27 公開日 2019-02-06 最終更新日 2024-05-15 実験手法 SOLUTION NMR 主引用文献 Solution structure of the inhibitor of cysteine proteases 1 from Entamoeba histolytica reveals a possible auto regulatory mechanism. Biochim Biophys Acta Proteins Proteom, 1868, 2020
5L3A	Fragment-based discovery of 6-arylindazole JAK inhibitors 分子名称: Tyrosine-protein kinase JAK2, ~{N}-(1~{H}-indazol-4-yl)methanesulfonamide 著者 Soerensen, M.D, Dack, K.N, Greve, D.R, Ritzen, A. 登録日 2016-04-06 公開日 2016-04-27 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (1.98 Å) 主引用文献 Fragment-Based Discovery of 6-Arylindazole JAK Inhibitors. Acs Med.Chem.Lett., 7, 2016
6CMG	Crystal Structure of the Hendra Virus Attachment G Glycoprotein Bound to a Potent Cross-Reactive Neutralizing Human Monoclonal Antibody m102.3 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, Glycoprotein G, ... 著者 Xu, K, Nikolov, D. 登録日 2018-03-05 公開日 2018-04-18 最終更新日 2020-07-29 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Crystal structure of the Hendra virus attachment G glycoprotein bound to a potent cross-reactive neutralizing human monoclonal antibody. PLoS Pathog., 9, 2013
6YE9	Small-molecule inhibitor of 14-3-3 protein-protein interactions 分子名称: 14-3-3 protein sigma, MAGNESIUM ION, [2-[2-oxidanylidene-2-[(phenylmethyl)amino]ethoxy]phenyl]phosphonic acid 著者 Ottmann, C, Visser, E.J. 登録日 2020-03-24 公開日 2021-03-31 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Structure-based conversion of a promiscuous inhibitor to a selective stabilizer of protein-protein interactions To Be Published
6Q48	CDK2 in complex with FragLite7 分子名称: 4-iodanyl-3~{H}-pyridin-2-one, Cyclin-dependent kinase 2, DIMETHYL SULFOXIDE 著者 Wood, D.J, Martin, M.P, Noble, M.E.M. 登録日 2018-12-05 公開日 2019-03-20 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.03 Å) 主引用文献 FragLites-Minimal, Halogenated Fragments Displaying Pharmacophore Doublets. An Efficient Approach to Druggability Assessment and Hit Generation. J.Med.Chem., 62, 2019
6Q4H	CDK2 in complex with FragLite36 分子名称: 2-[3-[(2-azanyl-9~{H}-purin-6-yl)oxy]phenyl]ethanoic acid, Cyclin-dependent kinase 2, DIMETHYL SULFOXIDE 著者 Wood, D.J, Martin, M.P, Noble, M.E.M. 登録日 2018-12-05 公開日 2019-03-20 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1 Å) 主引用文献 FragLites-Minimal, Halogenated Fragments Displaying Pharmacophore Doublets. An Efficient Approach to Druggability Assessment and Hit Generation. J.Med.Chem., 62, 2019
5L4Z	Crystal structure of enzyme in purine metabolism 分子名称: Cytosolic purine 5'-nucleotidase, GLYCEROL 著者 Hnizda, A, Pachl, P, Rezacova, P. 登録日 2016-05-27 公開日 2016-09-21 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.84 Å) 主引用文献 Oligomeric interface modulation causes misregulation of purine 5 -nucleotidase in relapsed leukemia. Bmc Biol., 14, 2016
6Y8P	Crystal structure of SNAP-tag labeled with a benzyl-tetramethylrhodamine fluorophore 分子名称: 1,2-ETHANEDIOL, O6-alkylguanine-DNA alkyltransferase mutant, ZINC ION, ... 著者 Gotthard, G, Tanzer, T, Johnsson, K, Hiblot, J. 登録日 2020-03-05 公開日 2021-03-31 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Kinetic and Structural Characterization of the Self-Labeling Protein Tags HaloTag7, SNAP-tag, and CLIP-tag. Biochemistry, 60, 2021
8WRA	The Crystal Structure of CASP1 from Biortus 分子名称: 1,2-ETHANEDIOL, Caspase-1 著者 Wang, F, Cheng, W, Yuan, Z, Lin, D, Guo, S. 登録日 2023-10-13 公開日 2023-11-15 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 The Crystal Structure of CASP1 from Biortus. To Be Published
6YDB	Human wtSTING in complex with 2',2'-difluoro-3',3'-c-di-GMP 分子名称: 2-azanyl-9-[(1~{R},6~{R},8~{R},9~{R},10~{R},15~{R},17~{R},18~{R})-17-(2-azanyl-6-oxidanylidene-1~{H}-purin-9-yl)-9,18-bis(fluoranyl)-3,12-bis(oxidanyl)-3,12-bis(oxidanylidene)-2,4,7,11,13,16-hexaoxa-3$l^{5},12$l^{5}-diphosphatricyclo[13.3.0.0^{6,10}]octadecan-8-yl]-1~{H}-purin-6-one, Stimulator of interferon protein 著者 Boura, E, Smola, M. 登録日 2020-03-20 公開日 2021-03-31 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.801 Å) 主引用文献 Ligand Strain and Its Conformational Complexity Is a Major Factor in the Binding of Cyclic Dinucleotides to STING Protein. Angew.Chem.Int.Ed.Engl., 60, 2021
8X1H	Crystal structure of N-terminal domain of Nucleocapsid protein of SARS-CoV-2 分子名称: GLYCEROL, Nucleoprotein 著者 Kumari, S, Gupta, G.D. 登録日 2023-11-07 公開日 2023-11-22 最終更新日 2024-07-03 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Unveiling potential inhibitors targeting the nucleocapsid protein of SARS-CoV-2: Structural insights into their binding sites. Int.J.Biol.Macromol., 273, 2024
6QB9	Structure of an anti-Mcl1 scFv 分子名称: L(+)-TARTARIC ACID, scFv55 著者 Hargreaves, D. 登録日 2018-12-20 公開日 2019-11-06 最終更新日 2019-11-13 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Antibody fragments structurally enable a drug-discovery campaign on the cancer target Mcl-1. Acta Crystallogr D Struct Biol, 75, 2019
6CDD	Npl4 zinc finger and MPN domains (Chaetomium thermophilum) 分子名称: Npl4 zinc finger, ZINC ION 著者 Bodnar, N.O, Rapoport, T.A. 登録日 2018-02-08 公開日 2018-07-04 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.58233714 Å) 主引用文献 Structure of the Cdc48 ATPase with its ubiquitin-binding cofactor Ufd1-Npl4. Nat. Struct. Mol. Biol., 25, 2018
6FY8	The crystal structure of EncM bromide soak 分子名称: BROMIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, Putative FAD-dependent oxygenase EncM 著者 Saleem-Batcha, R, Teufel, R. 登録日 2018-03-11 公開日 2018-05-02 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 Enzymatic control of dioxygen binding and functionalization of the flavin cofactor. Proc. Natl. Acad. Sci. U.S.A., 115, 2018
6FYA	The crystal structure of EncM under anaerobic conditions 分子名称: FLAVIN-ADENINE DINUCLEOTIDE, Putative FAD-dependent oxygenase EncM 著者 Saleem-Batcha, R, Teufel, R. 登録日 2018-03-11 公開日 2018-05-02 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Enzymatic control of dioxygen binding and functionalization of the flavin cofactor. Proc. Natl. Acad. Sci. U.S.A., 115, 2018
6FYH	Disulfide between ubiquitin G76C and the E3 HECT ligase Huwe1 分子名称: E3 ubiquitin-protein ligase HUWE1, Polyubiquitin-B, SULFATE ION, ... 著者 Jaeckl, M, Hartmann, M.D, Wiesner, S. 登録日 2018-03-12 公開日 2018-07-11 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.906 Å) 主引用文献 beta-Sheet Augmentation Is a Conserved Mechanism of Priming HECT E3 Ligases for Ubiquitin Ligation. J. Mol. Biol., 430, 2018
6FR5	HA1.7 TCR Study of CDR Loop Flexibility 分子名称: 1,2-ETHANEDIOL, ACETATE ION, GLYCEROL, ... 著者 Rizkallah, P.J, Cole, D.K. 登録日 2018-02-15 公開日 2018-04-18 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.37 Å) 主引用文献 In Silicoand Structural Analyses Demonstrate That Intrinsic Protein Motions Guide T Cell Receptor Complementarity Determining Region Loop Flexibility. Front Immunol, 9, 2018
6QDB	Leishmania major N-myristoyltransferase in complex with thienopyrimidine inhibitor IMP-0000081 分子名称: 3-[methyl-[2-[methyl(piperidin-4-yl)amino]thieno[3,2-d]pyrimidin-4-yl]amino]propanenitrile, Glycylpeptide N-tetradecanoyltransferase, MAGNESIUM ION, ... 著者 Brannigan, J.A. 登録日 2019-01-01 公開日 2020-05-06 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Novel Thienopyrimidine Inhibitors of Leishmania N -Myristoyltransferase with On-Target Activity in Intracellular Amastigotes. J.Med.Chem., 63, 2020
6FU8	uL23 beta hairpin loop deletion of E.coli ribosome 分子名称: 50S ribosomal protein L23 著者 Kudva, R, von Heijne, G, Carroni, M. 登録日 2018-02-26 公開日 2018-12-05 最終更新日 2024-05-15 実験手法 ELECTRON MICROSCOPY (3.2 Å) 主引用文献 The shape of the bacterial ribosome exit tunnel affects cotranslational protein folding. Elife, 7, 2018
6FUM	F11 T-Cell Receptor Recognising PKYVKQNTLKLAT Peptide Presented by HLA-DR*0101 分子名称: 1,2-ETHANEDIOL, 1-ETHOXY-2-(2-ETHOXYETHOXY)ETHANE, Human F11 T-Cell Receptor alpha chain, ... 著者 Rizkallah, P.J, Cole, D.K. 登録日 2018-02-27 公開日 2018-04-18 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.76 Å) 主引用文献 In Silicoand Structural Analyses Demonstrate That Intrinsic Protein Motions Guide T Cell Receptor Complementarity Determining Region Loop Flexibility. Front Immunol, 9, 2018
6QH5	AP2 clathrin adaptor mu2T156-phosphorylated core in closed conformation 分子名称: AP-2 complex subunit alpha, AP-2 complex subunit beta, AP-2 complex subunit mu, ... 著者 Wrobel, A.G, Owen, D.J, McCoy, A.J, Evans, P.R. 登録日 2019-01-15 公開日 2019-09-04 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.56 Å) 主引用文献 Temporal Ordering in Endocytic Clathrin-Coated Vesicle Formation via AP2 Phosphorylation. Dev.Cell, 50, 2019
2IXA	A-zyme, N-acetylgalactosaminidase 分子名称: (4R)-2-METHYLPENTANE-2,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, ALPHA-N-ACETYLGALACTOSAMINIDASE, ... 著者 Sulzenbacher, G, Liu, Q.P, Bourne, Y, Henrissat, B, Clausen, H. 登録日 2006-07-07 公開日 2007-04-10 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Bacterial Glycosidases for the Production of Universal Red Blood Cells. Nat.Biotechnol., 25, 2007

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