PDB: 47120 件ウェブページステータス検索Chemie searchBIRD

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5G5R	CBS domain tandem of site-2 protease from Archaeoglobus fulgidus in complex with llama Nanobody - apo form 分子名称: NANOBODY, SITE-2 PROTEASE, SULFATE ION 著者 Schacherl, M, Baumann, U. 登録日 2016-06-02 公開日 2017-05-24 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Crystallographic and biochemical characterization of the dimeric architecture of site-2 protease. Biochim. Biophys. Acta, 1859, 2017
3UVD	Crystal Structure of the bromodomain of human Transcription activator BRG1 (SMARCA4) in complex with N-Methyl-2-pyrrolidone 分子名称: 1-methylpyrrolidin-2-one, Transcription activator BRG1 著者 Filippakopoulos, P, Felletar, I, Picaud, S, Keates, T, Muniz, J, Gileadi, O, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Weigelt, J, Bountra, C, Knapp, S, Structural Genomics Consortium (SGC) 登録日 2011-11-29 公開日 2012-01-18 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Histone recognition and large-scale structural analysis of the human bromodomain family. Cell(Cambridge,Mass.), 149, 2012
4ZSQ	BACE crystal structure with tricyclic aminothiazine inhibitor 分子名称: Beta-secretase 1, GLYCEROL, N-[(4S,4aS,6S,8aR)-10-aminohexahydro-3H-4,8a-(epithiomethenoazeno)isochromen-6(1H)-yl]-3-chlorobenzamide 著者 Timm, D.E. 登録日 2015-05-13 公開日 2015-06-10 最終更新日 2015-06-17 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Preparation and biological evaluation of conformationally constrained BACE1 inhibitors. Bioorg.Med.Chem., 23, 2015
3UW5	Crystal structure of the BIR domain of MLIAP bound to GDC0152 分子名称: Baculoviral IAP repeat-containing protein 7, Baculoviral IAP repeat-containing protein 4, GDC-0152, ... 著者 Maurer, B, Hymowitz, S.G. 登録日 2011-11-30 公開日 2012-02-22 最終更新日 2017-08-02 実験手法 X-RAY DIFFRACTION (1.71 Å) 主引用文献 Discovery of a Potent Small-Molecule Antagonist of Inhibitor of Apoptosis (IAP) Proteins and Clinical Candidate for the Treatment of Cancer (GDC-0152). J.Med.Chem., 55, 2012
3UWJ	Human Thrombin In Complex With MI353 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Hirudin variant-2, N-(benzylsulfonyl)-D-leucyl-N-(4-carbamimidoylbenzyl)-L-prolinamide, ... 著者 Biela, A, Heine, A, Klebe, G. 登録日 2011-12-02 公開日 2012-12-12 最終更新日 2023-12-06 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Ligand binding stepwise disrupts water network in thrombin: enthalpic and entropic changes reveal classical hydrophobic effect J.Med.Chem., 55, 2012
3UZW	Crystal structure of 5beta-reductase (AKR1D1) E120H mutant in complex with NADP+ 分子名称: 3-oxo-5-beta-steroid 4-dehydrogenase, CHLORIDE ION, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE 著者 Chen, M, Christianson, D.W, Penning, T.M. 登録日 2011-12-07 公開日 2012-03-21 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.892 Å) 主引用文献 Conversion of Human Steroid 5beta-Reductase (AKR1D1) into 3β-Hydroxysteroid Dehydrogenase by Single Point Mutation E120H: EXAMPLE OF PERFECT ENZYME ENGINEERING. J.Biol.Chem., 287, 2012
2DZY	Crystal structure of N392A mutant of yeast bleomycin hydrolase 分子名称: Cysteine proteinase 1 著者 O'Farrell, P.A, Joshua-Tor, L. 登録日 2006-09-30 公開日 2007-08-14 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (2.57 Å) 主引用文献 Mutagenesis and crystallographic studies of the catalytic residues of the papain family protease bleomycin hydrolase: new insights into active-site structure Biochem.J., 401, 2007
5CR6	Structure of pneumolysin at 1.98 A resolution 分子名称: Pneumolysin 著者 Marshall, J.E, Faraj, B.H.A, Gingras, A.R, Lonnen, R, Sheikh, M.A, El-Mezgueldi, M, Moody, P.C.E, Andrew, P.W, Wallis, R. 登録日 2015-07-22 公開日 2015-09-16 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.98 Å) 主引用文献 The Crystal Structure of Pneumolysin at 2.0 angstrom Resolution Reveals the Molecular Packing of the Pre-pore Complex. Sci Rep, 5, 2015
5S8G	XChem group deposition -- Crystal Structure of the second bromodomain of pleckstrin homology domain interacting protein (PHIP) in complex with N00804d (space group C2) 分子名称: 1,3-benzothiazole-6-carboxylic acid, PH-interacting protein 著者 Krojer, T, Talon, R, Fairhead, M, Szykowska, A, Burgess-Brown, N.A, Brennan, P.E, Arrowsmith, C.H, Edwards, A.M, Bountra, C, von Delft, F. 登録日 2020-12-17 公開日 2021-01-13 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.19 Å) 主引用文献 XChem group deposition To Be Published
3V2O	Crystal Structure of the Peptide Bound Complex of the Ankyrin Repeat Domains of Human ANKRA2 分子名称: Ankyrin repeat family A protein 2, Low-density lipoprotein receptor-related protein 2 著者 Lam, R, Xu, C, Bian, C.B, Kania, J, Bountra, C, Weigelt, J, Arrowsmith, C.H, Edwards, A.M, Bochkarev, A, Min, J, Structural Genomics Consortium (SGC) 登録日 2011-12-12 公開日 2012-04-04 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.89 Å) 主引用文献 Sequence-Specific Recognition of a PxLPxI/L Motif by an Ankyrin Repeat Tumbler Lock. Sci.Signal., 5, 2012
5S8K	XChem group deposition -- Crystal Structure of the second bromodomain of pleckstrin homology domain interacting protein (PHIP) in complex with N01225c (space group C2) 分子名称: 3,4-dimethyl-1,2-oxazol-5-amine, PH-interacting protein 著者 Krojer, T, Talon, R, Fairhead, M, Szykowska, A, Burgess-Brown, N.A, Brennan, P.E, Arrowsmith, C.H, Edwards, A.M, Bountra, C, von Delft, F. 登録日 2020-12-17 公開日 2021-01-13 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.24 Å) 主引用文献 XChem group deposition To Be Published
3V31	Crystal Structure of the Peptide Bound Complex of the Ankyrin Repeat Domains of Human ANKRA2 分子名称: Ankyrin repeat family A protein 2, CHLORIDE ION, Histone deacetylase 4, ... 著者 Lam, R, Xu, C, Bian, C.B, Kania, J, Bountra, C, Weigelt, J, Arrowsmith, C.H, Edwards, A.M, Bochkarev, A, Min, J, Structural Genomics Consortium (SGC) 登録日 2011-12-12 公開日 2012-04-04 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.57 Å) 主引用文献 Sequence-Specific Recognition of a PxLPxI/L Motif by an Ankyrin Repeat Tumbler Lock. Sci.Signal., 5, 2012
3UZU	The structure of the Ribosomal RNA small subunit methyltransferase A from Burkholderia pseudomallei 分子名称: 1,2-ETHANEDIOL, Ribosomal RNA small subunit methyltransferase A 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2011-12-07 公開日 2011-12-14 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.75 Å) 主引用文献 The structure of the Ribosomal RNA small subunit methyltransferase A from Burkholderia pseudomallei TO BE PUBLISHED
5G6F	Structure of Bacillus subtilis Nitric Oxide Synthase in complex with 7-(((3-((Dimethylamino)methyl)phenyl)amino)methyl) quinolin-2-amine 分子名称: 5,6,7,8-TETRAHYDROBIOPTERIN, 7-[[[3-[(dimethylamino)methyl]phenyl]amino]methyl]quinolin-2-amine, CHLORIDE ION, ... 著者 Holden, J.K, Poulos, T.L. 登録日 2016-06-18 公開日 2016-09-21 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.26 Å) 主引用文献 Targeting Bacterial Nitric Oxide Synthase with Aminoquinoline-Based Inhibitors. Biochemistry, 55, 2016
1YAR	Structure of Archeabacterial 20S proteasome mutant D9S- PA26 complex 分子名称: GLYCEROL, Proteasome alpha subunit, Proteasome beta subunit, ... 著者 Forster, A, Masters, E.I, Whitby, F.G, Robinson, H, Hill, C.P. 登録日 2004-12-17 公開日 2005-07-26 最終更新日 2023-08-23 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 The 1.9 A structure of a proteasome-11S activator complex and implications for proteasome-PAN/PA700 interactions. Mol.Cell, 18, 2005
3V0Q	Crystal structure of the Fucosylgalactoside alpha N-acetylgalactosaminyltransferase (GTA, cisAB mutant L266G, G268A) in complex with UDP and H-antigen acceptor 分子名称: GLYCEROL, Histo-blood group ABO system transferase, MANGANESE (II) ION, ... 著者 Palcic, M.M, Jorgensen, R. 登録日 2011-12-08 公開日 2013-01-23 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Base-modified Donor Analogues Reveal Novel Dynamic Features of a Glycosyltransferase. J.Biol.Chem., 288, 2013
5S72	PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 NendoU in complex with BBL029427 分子名称: CITRIC ACID, N-(2-aminoethyl)-N'-phenylurea, Uridylate-specific endoribonuclease 著者 Godoy, A.S, Douangamath, A, Nakamura, A.M, Dias, A, Krojer, T, Noske, G.D, Gawiljuk, V.O, Fernandes, R.S, Fairhead, M, Powell, A, Dunnet, L, Aimon, A, Fearon, D, Brandao-Neto, J, Skyner, R, von Delft, F, Oliva, G. 登録日 2020-11-13 公開日 2020-11-25 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (2.512 Å) 主引用文献 Allosteric regulation and crystallographic fragment screening of SARS-CoV-2 NSP15 endoribonuclease. Nucleic Acids Res., 2023
5G2T	BT1596 in complex with its substrate 4,5 unsaturated uronic acid alpha 1,4 D-Glucosamine-2-N, 6-O-disulfate 分子名称: 1,2-ETHANEDIOL, 2-O GLYCOSAMINOGLYCAN SULFATASE, 4-deoxy-2-O-sulfo-alpha-L-threo-hex-4-enopyranuronic acid, ... 著者 Cartmell, A, Lowe, E.C, Basle, A, Crouch, L.I, Czjzek, M, Turnbull, J, Henrissat, B, Terrapon, N, Thomas, S, Murray, H, Firbank, S.J, Bolam, D.N. 登録日 2016-04-13 公開日 2017-05-24 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 How members of the human gut microbiota overcome the sulfation problem posed by glycosaminoglycans. Proc. Natl. Acad. Sci. U.S.A., 114, 2017
5S8J	XChem group deposition -- Crystal Structure of the second bromodomain of pleckstrin homology domain interacting protein (PHIP) in complex with N01207d (space group C2) 分子名称: 5-chloro-N,1-dimethyl-1H-pyrazole-4-carboxamide, PH-interacting protein 著者 Krojer, T, Talon, R, Fairhead, M, Szykowska, A, Burgess-Brown, N.A, Brennan, P.E, Arrowsmith, C.H, Edwards, A.M, Bountra, C, von Delft, F. 登録日 2020-12-17 公開日 2021-01-13 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.21 Å) 主引用文献 XChem group deposition To Be Published
2E5Y	Epsilon subunit and ATP complex of F1F0-ATP synthase from the Thermophilic Bacillus PS3 分子名称: ADENOSINE-5'-TRIPHOSPHATE, ATP synthase epsilon chain 著者 Yagi, H, Akutsu, H. 登録日 2006-12-25 公開日 2007-07-10 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.92 Å) 主引用文献 Structures of the thermophilic F1-ATPase {varepsilon} subunit suggesting ATP-regulated arm motion of its C-terminal domain in F1 Proc.Natl.Acad.Sci.Usa, 104, 2007
5GM3	Crystal structure of FI-CMCase from Aspergillus aculeatus F-50 分子名称: CACODYLATE ION, Endoglucanase-1, ZINC ION 著者 Huang, J.W, Liu, W.D, Zheng, Y.Y, Chen, C.C, Guo, R.T. 登録日 2016-07-12 公開日 2017-05-17 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.59 Å) 主引用文献 Crystal structure and genetic modifications of FI-CMCase from Aspergillus aculeatus F-50 Biochem. Biophys. Res. Commun., 478, 2016
3V2B	Human poly(adp-ribose) polymerase 15 (ARTD7, BAL3), macro domain 2 in complex with adenosine-5-diphosphoribose 分子名称: Poly [ADP-ribose] polymerase 15, [(2R,3S,4R,5R)-5-(6-AMINOPURIN-9-YL)-3,4-DIHYDROXY-OXOLAN-2-YL]METHYL [HYDROXY-[[(2R,3S,4R,5S)-3,4,5-TRIHYDROXYOXOLAN-2-YL]METHOXY]PHOSPHORYL] HYDROGEN PHOSPHATE 著者 Karlberg, T, Moche, M, Arrowsmith, C.H, Berglund, H, Bountra, C, Collins, R, Edwards, A.M, Flodin, S, Flores, A, Graslund, S, Hammarstrom, M, Johansson, I, Kallas, A, Kotenyova, T, Kotzcsh, A, Kraulis, P, Nielsen, T.K, Nordlund, P, Nyman, T, Persson, C, Roos, A.K, Schutz, P, Siponen, M.I, Thorsell, A.G, Tresaugues, L, Van den berg, S, Weigelt, J, Welin, M, Wisniewska, M, Schuler, H, Structural Genomics Consortium (SGC) 登録日 2011-12-12 公開日 2011-12-21 最終更新日 2024-05-29 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Recognition of Mono-ADP-Ribosylated ARTD10 Substrates by ARTD8 Macrodomains. Structure, 21, 2013
5S8Q	XChem group deposition -- Crystal Structure of the second bromodomain of pleckstrin homology domain interacting protein (PHIP) in complex with FMO3D000185a (space group P212121) 分子名称: (3R)-3-methyl-1,2,3,4-tetrahydro-5H-1,4-benzodiazepin-5-one, 1,2-ETHANEDIOL, CALCIUM ION, ... 著者 Krojer, T, Talon, R, Fairhead, M, Szykowska, A, Burgess-Brown, N.A, Brennan, P.E, Arrowsmith, C.H, Edwards, A.M, Bountra, C, von Delft, F. 登録日 2020-12-17 公開日 2021-01-13 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 XChem group deposition To Be Published
5CR5	X-RAY CRYSTAL STRUCTURE AT 1.61A RESOLUTION OF HUMAN MITOCHONDRIAL BRANCHED CHAIN AMINOTRANSFERASE (BCATM) COMPLEXED WITH A BIPHENYL PYRROLIDINE ETHER COMPOUND AND AN INTERNAL ALDIMINE LINKED PLP COFACTOR. 分子名称: 1,2-ETHANEDIOL, 3-({(3R)-1-[(5-bromothiophen-2-yl)carbonyl]pyrrolidin-3-yl}oxy)-N-methyl-2'-[(methylsulfonyl)amino]biphenyl-4-carboxamide, Branched-chain-amino-acid aminotransferase, ... 著者 Somers, D.O. 登録日 2015-07-22 公開日 2015-08-12 最終更新日 2015-09-02 実験手法 X-RAY DIFFRACTION (1.61 Å) 主引用文献 Discovery, SAR, and X-ray Binding Mode Study of BCATm Inhibitors from a Novel DNA-Encoded Library. Acs Med.Chem.Lett., 6, 2015
5GMF	Crystal structure of monkey TLR7 in complex with guanosine and polyU 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, CALCIUM ION, ... 著者 Zhang, Z, Ohto, U, Shimizu, T. 登録日 2016-07-14 公開日 2016-11-02 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Structural Analysis Reveals that Toll-like Receptor 7 Is a Dual Receptor for Guanosine and Single-Stranded RNA Immunity, 45, 2016

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