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

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6T82	3C-like protease from Southampton virus complexed with FMOPL000542a. 分子名称: 4,6-dimethyl-~{N}-phenyl-pyrimidin-2-amine, DIMETHYL SULFOXIDE, Genome polyprotein, ... 著者 Guo, J, Cooper, J.B. 登録日 2019-10-23 公開日 2020-08-19 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.46 Å) 主引用文献 In crystallo-screening for discovery of human norovirus 3C-like protease inhibitors. J Struct Biol X, 4, 2020
5LR5	N6-methyladenine is accommodated in a conventional A-U basepair 分子名称: RNA (5'-R(*GP*GP*(6MZ)P*CP*UP*AP*GP*UP*(CBV)P*C)-3'), SULFATE ION 著者 Huang, L, Lilley, D.M.J. 登録日 2016-08-18 公開日 2017-06-21 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Control of box C/D snoRNP assembly by N(6)-methylation of adenine. EMBO Rep., 18, 2017
6T3D	Crystal structure of AmpC from E.coli 分子名称: 1,2-ETHANEDIOL, Beta-lactamase, CHLORIDE ION, ... 著者 Lang, P.A, Leissing, T.M, Schofield, C.J, Brem, J. 登録日 2019-10-10 公開日 2020-06-24 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Bicyclic Boronates as Potent Inhibitors of AmpC, the Class C beta-Lactamase from Escherichia coli . Biomolecules, 10, 2020
6T8D	The cytotoxin MakB from Vibrio cholerae 分子名称: MakB, SULFATE ION 著者 Persson, K, Nagampalli, R. 登録日 2019-10-24 公開日 2020-11-18 最終更新日 2021-12-01 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 A tripartite cytolytic toxin formed by Vibrio cholerae proteins with flagellum-facilitated secretion. Proc.Natl.Acad.Sci.USA, 118, 2021
5M10	Crystal structure of cyclohexanone monooxygenase from Thermocrispum municipale in the oxidised state with a bound nicotinamide. 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Cyclohexanone Monooxygenase from Thermocrispum municipale, FLAVIN-ADENINE DINUCLEOTIDE, ... 著者 Gomez-Castellanos, J.R, Mattevi, A. 登録日 2016-10-06 公開日 2016-12-07 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (1.22 Å) 主引用文献 Characterization and Crystal Structure of a Robust Cyclohexanone Monooxygenase. Angew. Chem. Int. Ed. Engl., 55, 2016
5M16	Structure of GH36 alpha-galactosidase from Thermotoga maritima in complex with a hydrolysed cyclopropyl carbasugar. 分子名称: (1~{R},2~{S},3~{S},4~{S},5~{S},6~{S})-1-(hydroxymethyl)bicyclo[4.1.0]heptane-2,3,4,5-tetrol, Alpha-galactosidase, MAGNESIUM ION, ... 著者 Pengelly, R, Gloster, T. 登録日 2016-10-07 公開日 2016-11-09 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.62 Å) 主引用文献 Structural Snapshots for Mechanism-Based Inactivation of a Glycoside Hydrolase by Cyclopropyl Carbasugars. Angew.Chem.Int.Ed.Engl., 55, 2016
6T8T	3C-like protease from Southampton virus complexed with FMOPL000603a. 分子名称: 2-(4-ethoxyphenyl)ethanoic acid, DIMETHYL SULFOXIDE, Genome polyprotein, ... 著者 Guo, J, Cooper, J.B. 登録日 2019-10-24 公開日 2020-08-19 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.68 Å) 主引用文献 In crystallo-screening for discovery of human norovirus 3C-like protease inhibitors. J Struct Biol X, 4, 2020
5LRQ	BRD4 in complex with ERK5 inhibitor XMD8-92 分子名称: 2-{[2-ethoxy-4-(4-hydroxypiperidin-1-yl)phenyl]amino}-5,11-dimethyl-5,11-dihydro-6H-pyrimido[4,5-b][1,4]benzodiazepin-6-one, Bromodomain-containing protein 4 著者 Martin, M.P, Noble, M.E.M. 登録日 2016-08-19 公開日 2017-08-30 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Identification of a novel orally bioavailable ERK5 inhibitor with selectivity over p38 alpha and BRD4. Eur.J.Med.Chem., 178, 2019
5M1A	Crystal structure of PBP2a from MRSA in the presence of Ceftazidime ligand 分子名称: CADMIUM ION, Penicillin-binding protein 2, beta-muramic acid 著者 Molina, R, Batuecas, M.T, Hermoso, J.A. 登録日 2016-10-07 公開日 2017-02-08 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Conformational Dynamics in Penicillin-Binding Protein 2a of Methicillin-Resistant Staphylococcus aureus, Allosteric Communication Network and Enablement of Catalysis. J. Am. Chem. Soc., 139, 2017
5LRX	Structure of A20 OTU domain bound to ubiquitin 分子名称: Polyubiquitin-B, Tumor necrosis factor alpha-induced protein 3 著者 Mevissen, T.E.T, Kulathu, Y, Mulder, M.P.C, Geurink, P.P, Maslen, S.L, Gersch, M, Elliott, P.R, Burke, J.E, van Tol, B.D.M, Akutsu, M, El Oualid, F, Kawasaki, M, Freund, S.M.V, Ovaa, H, Komander, D. 登録日 2016-08-22 公開日 2016-10-19 最終更新日 2017-09-13 実験手法 X-RAY DIFFRACTION (2.85 Å) 主引用文献 Molecular basis of Lys11-polyubiquitin specificity in the deubiquitinase Cezanne. Nature, 538, 2016
6T4Y	ROR(gamma)t ligand binding domain in complex with 25-hydroxycholesterol and allosteric ligand MRL871 分子名称: 25-HYDROXYCHOLESTEROL, 4-{1-[2-chloro-6-(trifluoromethyl)benzoyl]-1H-indazol-3-yl}benzoic acid, GLYCEROL, ... 著者 de Vries, R.M.J.M, Meijer, F.A, Brunsveld, L. 登録日 2019-10-15 公開日 2020-11-18 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Cooperativity between the orthosteric and allosteric ligand binding sites of ROR gamma t. Proc.Natl.Acad.Sci.USA, 118, 2021
5LT3	nucleotide-free kinesin-1 motor domain T87A mutant, P1 crystal form 分子名称: Kinesin-1 heavy chain, SULFATE ION 著者 Cao, L, Gigant, B. 登録日 2016-09-06 公開日 2017-03-01 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.59 Å) 主引用文献 The structural switch of nucleotide-free kinesin. Sci Rep, 7, 2017
5LU4	C4-type pyruvate phosphate dikinase: conformational intermediate of central domain in the swiveling mechanism 分子名称: ADENOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, PYRUVIC ACID, ... 著者 Minges, A, Hoeppner, A, Groth, G. 登録日 2016-09-08 公開日 2017-05-24 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.9 Å) 主引用文献 Trapped intermediate state of plant pyruvate phosphate dikinase indicates substeps in catalytic swiveling domain mechanism. Protein Sci., 26, 2017
6TA8	Crystal structure of the epimerization domain from the third module of tyrocidine synthetase B, TycB3(E) 分子名称: Tyrocidine synthase 2 著者 Fage, C.D, Marahiel, M.A. 登録日 2019-10-29 公開日 2020-11-18 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Communication Breakdown: Dissecting the COM Interfaces between the Subunits of Nonribosomal Peptide Synthetases Acs Catalysis, 2021
6TAH	Crystal structure of a Nu-class Glutathione-S-Transferase from Pseudomonas aeruginosa PACS2 bound to glutathione 分子名称: 1,2-ETHANEDIOL, GLYCEROL, Glutathione S-transferase, ... 著者 Feiler, C.G, Blankenfeldt, W. 登録日 2019-10-29 公開日 2020-09-16 実験手法 X-RAY DIFFRACTION (1.3 Å) 主引用文献 Structure of nu-class glutathione transferase from Pseudomonas aeruginosa related to YfcG from E. coli To Be Published
5LV0	Structure of Human Neurolysin (E475Q) in complex with amyloid-beta 35-40 peptide product 分子名称: CHLORIDE ION, GLY-VAL-VAL amyloid 35-40 fragment, Neurolysin, ... 著者 Masuyer, G, Berntsson, R.P.-A, Teixeira, P.F, Kmiec, B, Glaser, E, Stenmark, P. 登録日 2016-09-12 公開日 2017-12-06 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Structural and functional analysis of Neurolysin, a new component of the mitochondrial peptidolytic network To Be Published
6TBF	Structure of a beta galactosidase with inhibitor 分子名称: (1~{S},2~{S},3~{S},4~{R},5~{R})-4-(hydroxymethyl)-5-(octylamino)cyclopentane-1,2,3-triol, ACETATE ION, Beta-galactosidase, ... 著者 Offen, W, Davies, G. 登録日 2019-11-01 公開日 2020-08-19 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Mechanistic Insights into the Chaperoning of Human Lysosomal-Galactosidase Activity: Highly Functionalized Aminocyclopentanes and C -5a-Substituted Derivatives of 4- epi -Isofagomine. Molecules, 25, 2020
5LXZ	W288A mutant of GlxA from Streptomyces lividans: Cu-bound form 分子名称: 1,2-ETHANEDIOL, ACETATE ION, COPPER (II) ION, ... 著者 Chaplin, A.K, Hough, M.A, Worrall, J.A.R. 登録日 2016-09-23 公開日 2017-07-26 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.49 Å) 主引用文献 The role of a second-coordination sphere tryptophan residue in the maturation of the catalytic metalloradical site in the auxillary activity family 5 (AA5) GlxA from Streptomyces lividans to be published
6TH5	Crystal structure of mature wildtype primitive Phytochelatin synthase from Nostoc spec. - Alr0975 分子名称: Alr0975 protein, CALCIUM ION 著者 Feiler, C.G, Blankenfeldt, W. 登録日 2019-11-18 公開日 2020-11-25 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.99 Å) 主引用文献 Crystal structure of mature wildtype primitive Phytochelatin synthase from Nostoc spec. - Alr0975 To Be Published
5LY9	Structure of MITat 1.1 分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, GLYCEROL, Variant surface glycoprotein MITAT 1.1, ... 著者 Schaefer, C, Bartossek, T, Jones, N, Kuper, J, Kisker, C, Engstler, M. 登録日 2016-09-26 公開日 2017-09-20 最終更新日 2020-07-29 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Structural basis for the shielding function of the dynamic trypanosome variant surface glycoprotein coat. Nat Microbiol, 2, 2017
6TIX	Crystal structure of penicillin-binding protein 2 from Yersinia pestis in complex with mecillinam 分子名称: 2-[(1R)-1-{[(E)-azepan-1-ylmethylidene]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, Peptidoglycan D,D-transpeptidase MrdA 著者 Pankov, G, Hunter, W.N, Dawson, A. 登録日 2019-11-22 公開日 2020-12-02 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 The structure of penicillin-binding protein 2 from Yersinia pestis in complex with mecillinam To Be Published
6TJ7	T. gondii myosin A trimeric complex 分子名称: 1,3-PROPANDIOL, CALCIUM ION, CHLORIDE ION, ... 著者 Pazicky, S, Loew, C. 登録日 2019-11-25 公開日 2020-10-21 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Structural role of essential light chains in the apicomplexan glideosome. Commun Biol, 3, 2020
6TJE	Crystal structure of the computationally designed Cake5 protein 分子名称: Cake5 著者 Mylemans, B, Laier, I, Noguchi, H, Voet, A.R.D. 登録日 2019-11-26 公開日 2020-05-06 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (3.15 Å) 主引用文献 Structural plasticity of a designer protein sheds light on beta-propeller protein evolution. Febs J., 288, 2021
6TJK	Crystal Structure of Recombinant GBA in Complex with Bis-Tris Propane. 分子名称: 1,2-ETHANEDIOL, 2-[3-(2-HYDROXY-1,1-DIHYDROXYMETHYL-ETHYLAMINO)-PROPYLAMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ... 著者 Rowland, R.J, Davies, G.J. 登録日 2019-11-26 公開日 2020-06-10 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (1.56 Å) 主引用文献 A baculoviral system for the production of human beta-glucocerebrosidase enables atomic resolution analysis. Acta Crystallogr D Struct Biol, 76, 2020
5M0M	Structure-based evolution of a hybrid steroid series of Autotaxin inhibitors 分子名称: (2R)-2-hydroxy-3-(phosphonooxy)propyl (9E)-octadec-9-enoate, CALCIUM ION, Ectonucleotide pyrophosphatase/phosphodiesterase family member 2, ... 著者 Keune, W.-J, Heidebrecht, T, Perrakis, A. 登録日 2016-10-05 公開日 2017-08-16 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Rational Design of Autotaxin Inhibitors by Structural Evolution of Endogenous Modulators. J. Med. Chem., 60, 2017

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