PDB: 30867 件ウェブページステータス検索Chemie searchBIRD

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6Z5G	The RSL - sulfonato-calix[8]arene complex, I23 form, citrate pH 4.0, solved by S-SAD 分子名称: Fucose-binding lectin protein, GLYCEROL, beta-D-fructopyranose, ... 著者 Engilberge, S, Ramberg, K, Crowley, P.B. 登録日 2020-05-26 公開日 2021-04-14 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.278 Å) 主引用文献 Facile Fabrication of Protein-Macrocycle Frameworks. J.Am.Chem.Soc., 143, 2021
6QV8	Staphylococcus aureus superoxide dismutase SodM double mutant 分子名称: MANGANESE (II) ION, Superoxide dismutase 著者 Basle, A, Barwinska-Sendra, A, Waldron, K. 登録日 2019-03-01 公開日 2020-03-25 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 An evolutionary path to altered cofactor specificity in a metalloenzyme. Nat Commun, 11, 2020
7LCA	Zoogloea ramigera biosynthetic thiolase Y218E/delH221 mutant 分子名称: Acetyl-CoA acetyltransferase, CHLORIDE ION, COENZYME A, ... 著者 Marshall, A.C, Bruning, J.B. 登録日 2021-01-10 公開日 2021-09-01 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Engineering potassium activation into biosynthetic thiolase. Biochem.J., 478, 2021
6Z5P	The RSL-R8 - sulfonato-calix[8]arene complex, P3 form, TRIS-HCl pH 8.5 分子名称: Fucose-binding lectin protein, GLYCEROL, SULFATE ION, ... 著者 Ramberg, K, Skorek, T, Engilberge, S, Crowley, P.B. 登録日 2020-05-27 公開日 2021-04-07 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.42 Å) 主引用文献 Facile Fabrication of Protein-Macrocycle Frameworks. J.Am.Chem.Soc., 143, 2021
8BQ4	Crystal Structure of Phosphatidylinositol 5-Phosphate 4-Kinase (PI5P4K2C) bound to an inhibitor 分子名称: 6-methyl-~{N}-(4-methylsulfonylphenyl)thieno[2,3-d]pyrimidin-4-amine, Phosphatidylinositol 5-phosphate 4-kinase type-2 gamma 著者 Ogg, D.J, Howard, T.D. 登録日 2022-11-18 公開日 2022-12-28 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (2.42 Å) 主引用文献 The Identification of Potent, Selective, and Brain Penetrant PI5P4K gamma Inhibitors as In Vivo-Ready Tool Molecules. J.Med.Chem., 66, 2023
7LPP	Crystal structure of Cryptococcus neoformans sterylglucosidase 1 with hit 1 分子名称: 4-(hydroxymethyl)-1-[[2-(3-methoxyphenyl)-1,3-thiazol-5-yl]methyl]piperidin-4-ol, Cytoplasmic protein, GLYCEROL, ... 著者 Pereira de Sa, N, Del Poeta, M, Airola, M.V. 登録日 2021-02-12 公開日 2021-09-01 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (2.85 Å) 主引用文献 Structure and inhibition of Cryptococcus neoformans sterylglucosidase to develop antifungal agents. Nat Commun, 12, 2021
6Z5M	The RSL - sulfonato-calix[8]arene complex, I23 form, Gly-HCl pH 2.2 分子名称: Fucose-binding lectin protein, GLYCEROL, beta-D-fructopyranose, ... 著者 Ramberg, K, Engilberge, S, Crowley, P.B. 登録日 2020-05-26 公開日 2021-04-14 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Facile Fabrication of Protein-Macrocycle Frameworks. J.Am.Chem.Soc., 143, 2021
5FK3	SAM-I riboswitch bearing the H. marismortui Kt-7 variant 3bn is CC 分子名称: BARIUM ION, POTASSIUM ION, S-ADENOSYLMETHIONINE, ... 著者 Huang, L, Lilley, D.M.J. 登録日 2015-10-14 公開日 2016-05-25 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 A Critical Base Pair in K-Turns Determines the Conformational Class Adopted, and Correlates with Biological Function. Nucleic Acids Res., 44, 2016
7LCL	Zoogloea ramigera biosynthetic thiolase Q183Y mutant 分子名称: AMMONIUM ION, Acetyl-CoA acetyltransferase, COENZYME A, ... 著者 Marshall, A.C, Bruning, J.B. 登録日 2021-01-11 公開日 2021-09-01 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.295 Å) 主引用文献 Engineering potassium activation into biosynthetic thiolase. Biochem.J., 478, 2021
7RN0	Crystal structure of the SARS-CoV-2 (COVID-19) main protease in complex with inhibitor Jun9-57-3R 分子名称: (2R)-2-{acetyl[4-(1H-pyrrol-1-yl)phenyl]amino}-N-[(1S)-1-phenylethyl]-2-(pyridin-3-yl)acetamide, 3C-like proteinase, GLYCEROL 著者 Sacco, M, Chen, Y. 登録日 2021-07-28 公開日 2021-08-11 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.25 Å) 主引用文献 Discovery of Di- and Trihaloacetamides as Covalent SARS-CoV-2 Main Protease Inhibitors with High Target Specificity. J.Am.Chem.Soc., 143, 2021
5VI4	IL-33/ST2/IL-1RAcP ternary complex structure 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Interleukin-1 receptor accessory protein, Interleukin-1 receptor-like 1, ... 著者 Guenther, S, Sundberg, E.J. 登録日 2017-04-13 公開日 2017-09-27 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.792 Å) 主引用文献 IL-1 Family Cytokines Use Distinct Molecular Mechanisms to Signal through Their Shared Co-receptor. Immunity, 47, 2017
6Z5W	The RSL - sulfonato-calix[8]arene complex, P213 form, MES pH 6.8 分子名称: Fucose-binding lectin protein, SULFATE ION, beta-D-fructopyranose, ... 著者 Engilberge, S, Ramberg, K, Crowley, P.B. 登録日 2020-05-27 公開日 2021-04-14 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.187 Å) 主引用文献 Facile Fabrication of Protein-Macrocycle Frameworks. J.Am.Chem.Soc., 143, 2021
6QR0	Crystal structure of TrmD, a tRNA-(N1G37) methyltransferase, from Mycobacterium abscessus in complex with inhibitor 分子名称: 5-azanyl-3-[1-(pyridin-4-ylmethyl)indol-6-yl]-1~{H}-pyrazole-4-carbonitrile, SULFATE ION, tRNA (guanine-N(1)-)-methyltransferase 著者 Thomas, S.E, Whitehouse, A.J, Coyne, A.G, Abell, C, Mendes, V, Blundell, T.L. 登録日 2019-02-19 公開日 2019-09-18 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.59 Å) 主引用文献 Development of Inhibitors against Mycobacterium abscessus tRNA (m1G37) Methyltransferase (TrmD) Using Fragment-Based Approaches. J.Med.Chem., 62, 2019
6QW8	Crystal structure of CTX-M-15 complexed with relebactam (16 hour soak) 分子名称: (2S,5R)-1-formyl-N-(piperidin-4-yl)-5-[(sulfooxy)amino]piperidine-2-carboxamide, Beta-lactamase, GLYCEROL, ... 著者 Tooke, C.L, Hinchliffe, P, Spencer, J. 登録日 2019-03-05 公開日 2019-08-21 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.1 Å) 主引用文献 Molecular Basis of Class A beta-Lactamase Inhibition by Relebactam. Antimicrob.Agents Chemother., 63, 2019
7RG2	Importin alpha2 in complex with MERS ORF4B R33A mutant 分子名称: Importin subunit alpha-1, ORF4b 著者 Munasinghe, T.S, Tsimbalyuk, S, Roby, J.A, Aragao, D, Forwood, J.K. 登録日 2021-07-14 公開日 2021-08-25 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 MERS-CoV ORF4b employs an unusual binding mechanism to target IMP alpha and block innate immunity. Nat Commun, 13, 2022
7LBZ	Zoogloea ramigera biosynthetic thiolase Y218E mutant 分子名称: Acetyl-CoA acetyltransferase, COENZYME A, SULFATE ION 著者 Marshall, A.C, Bruning, J.B. 登録日 2021-01-09 公開日 2021-09-01 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Engineering potassium activation into biosynthetic thiolase. Biochem.J., 478, 2021
5FK9	Crystal structure of staphylococcal enterotoxin A F47A mutant in complex with a T cell receptor 分子名称: ENTEROTOXIN TYPE A, T CELL RECEPTOR ALPHA CHAIN, T CELL RECEPTOR BETA CHAIN 著者 Rodstrom, K.E.J, Regenthal, P, Lindkvist-Petersson, K. 登録日 2015-10-15 公開日 2016-05-25 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (3.1 Å) 主引用文献 Two Common Structural Motifs for Tcr Recognition by Staphylococcal Enterotoxins Sci.Rep., 6, 2016
6Z5Z	The RSL-R6 - sulfonato-calix[8]arene complex, P213 form, TRIS-HCl pH 8.5 分子名称: Fucose-binding lectin protein, beta-D-fructopyranose, sulfonato-calix[8]arene 著者 Ramberg, K, Engilberge, S, Crowley, P.B. 登録日 2020-05-27 公開日 2021-04-14 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.124 Å) 主引用文献 Facile Fabrication of Protein-Macrocycle Frameworks. J.Am.Chem.Soc., 143, 2021
6QWE	Crystal structure of KPC-4 分子名称: Beta-lactamase, GLYCEROL, SULFATE ION 著者 Tooke, C.L, Hinchliffe, P, Spencer, J. 登録日 2019-03-05 公開日 2019-08-21 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Molecular Basis of Class A beta-Lactamase Inhibition by Relebactam. Antimicrob.Agents Chemother., 63, 2019
7REF	Structure of MS3494 from Mycobacterium smegmatis 分子名称: BROMIDE ION, MS3494 著者 Kent, J.E, Aleshin, A.E, Zhang, L, Niederweis, M, Marassi, F.M. 登録日 2021-07-12 公開日 2021-08-18 最終更新日 2022-06-08 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 A periplasmic cinched protein is required for siderophore secretion and virulence of Mycobacterium tuberculosis. Nat Commun, 13, 2022
6Z60	The RSL - sulfonato-calix[8]arene complex, P213 form, CAPS pH 9.5 分子名称: Fucose-binding lectin protein, SULFATE ION, beta-D-fructopyranose, ... 著者 Ramberg, K, Engilberge, S, Crowley, P.B. 登録日 2020-05-27 公開日 2021-04-14 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.166 Å) 主引用文献 Facile Fabrication of Protein-Macrocycle Frameworks. J.Am.Chem.Soc., 143, 2021
6QRC	Crystal structure of TrmD, a tRNA-(N1G37) methyltransferase, from Mycobacterium abscessus in complex with inhibitor 分子名称: 3-[1-[(3-methoxyphenyl)methyl]indol-6-yl]-1~{H}-pyrazol-5-amine, SULFATE ION, tRNA (guanine-N(1)-)-methyltransferase 著者 Thomas, S.E, Whitehouse, A.J, Coyne, A.G, Abell, C, Mendes, V, Blundell, T.L. 登録日 2019-02-19 公開日 2019-09-18 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.73 Å) 主引用文献 Development of Inhibitors against Mycobacterium abscessus tRNA (m1G37) Methyltransferase (TrmD) Using Fragment-Based Approaches. J.Med.Chem., 62, 2019
6Z6C	Crystal structurel of FleA lectin in complex with a monovalent inhibitor 分子名称: 4-((1-(2-(2-(2-(2-hydroxyethoxy)ethoxy)ethoxy)ethyl)-1H-1,2,3-triazol-4-yl)methoxy)benzyl-a-L-thiofucoside, Fucose-specific lectin, GLYCEROL, ... 著者 Varrot, A. 登録日 2020-05-28 公開日 2021-04-07 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Hexavalent thiofucosides to probe the role of the Aspergillus fumigatus lectin FleA in fungal pathogenicity. Org.Biomol.Chem., 19, 2021
5VJP	Crystal Structure of Adenine Phosphoribosyltransferase from Saccharomyces cerevisiae Complexed with L-2,5-Dideoxy-2,5-Imino-Altritol 1,6-Bisphosphate (L-DIAB) and Adenine 分子名称: 1,2-ETHANEDIOL, ADENINE, Adenine phosphoribosyltransferase 1, ... 著者 Harijan, R.K, Ducati, R.G, Bonanno, J.B, Almo, S.C, Schramm, V.L. 登録日 2017-04-19 公開日 2017-12-27 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.98 Å) 主引用文献 Synthesis of bis-Phosphate Iminoaltritol Enantiomers and Structural Characterization with Adenine Phosphoribosyltransferase. ACS Chem. Biol., 13, 2018
7RG6	Importin alpha2 in complex with ORF4B Bat coronavirus HKU5 分子名称: Importin subunit alpha-1, Non-structural protein ORF4b 著者 Foster, J.K, Tsimbalyuk, S, Roby, J.A, Aragao, D, Forwood, J.K. 登録日 2021-07-14 公開日 2021-08-25 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 MERS-CoV ORF4b employs an unusual binding mechanism to target IMP alpha and block innate immunity. Nat Commun, 13, 2022

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