PDB: 224004 件ウェブページステータス検索Chemie searchBIRD

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4ITO	Human CA II inhibition by novel sulfonamide 分子名称: 4-({[(4-METHYLPIPERAZIN-1-YL)AMINO]CARBONOTHIOYL}AMINO)BENZENESULFONAMIDE, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... 著者 Aggarwal, M, McKenna, R. 登録日 2013-01-18 公開日 2014-03-26 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.162 Å) 主引用文献 Human CA II inhibition by novel sulfonamide To be Published
4IND	The Triple Jelly Roll Fold and Turret Assembly in an Archaeal Virus 分子名称: C381 turret protein, DIHYDROGENPHOSPHATE ION 著者 Eilers, B.J, Kraft, D, Burgess, M.C, Young, M.J, Lawrence, C.M. 登録日 2013-01-04 公開日 2013-01-23 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 The Triple Jelly Roll Fold and Turret Assembly in an Archaeal Virus To be Published
4IQ0	Crystal structure of oxidoreductase, Gfo/Idh/MocA family from Streptococcus pneumoniae with reductive methylated Lysine 分子名称: Oxidoreductase, Gfo/Idh/MocA family, POTASSIUM ION 著者 Chang, C, Hatzos-Skintges, C, Abdullah, J, Joachimiak, A, Midwest Center for Structural Genomics (MCSG) 登録日 2013-01-10 公開日 2013-01-23 最終更新日 2017-11-15 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Crystal structure of oxidoreductase, Gfo/Idh/MocA family from Streptococcus pneumoniae with reductive methylated Lysine TO BE PUBLISHED
4J31	Crystal Structure of kynurenine 3-monooxygenase (KMO-396Prot) 分子名称: FLAVIN-ADENINE DINUCLEOTIDE, Kynurenine 3-monooxygenase 著者 Amaral, M, Levy, C, Heyes, D.J, Lafite, P, Outeiro, T.F, Giorgini, F, Leys, D, Scrutton, N.S. 登録日 2013-02-05 公開日 2013-04-10 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Structural basis of kynurenine 3-monooxygenase inhibition. Nature, 496, 2013
4HY8	Structures of PR1 and PR2 intermediates from time-resolved laue crystallography 分子名称: 4'-HYDROXYCINNAMIC ACID, Photoactive yellow protein 著者 Jung, Y.O, Lee, J.H, Kim, J, Schmidt, M, Vukica, S, Wulff, M, Moffat, K. 登録日 2012-11-13 公開日 2013-03-20 最終更新日 2017-11-15 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Volume-conserving trans-cis isomerization pathways in photoactive yellow protein visualized by picosecond X-ray crystallography NAT.CHEM., 5, 2013
4HZ6	crystal structure of BglB 分子名称: Beta-glucosidase, GLYCEROL 著者 Hwang, K.Y, Nam, K.H. 登録日 2012-11-14 公開日 2012-12-19 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Structural insights into the substrate recognition properties of beta-glucosidase. Biochem.Biophys.Res.Commun., 391, 2010
4HZE	Crystal structure of human Arginase-2 complexed with inhibitor 9 分子名称: Arginase-2, mitochondrial, BENZAMIDINE, ... 著者 Cousido-Siah, A, Mitschler, A, Ruiz, F.X, Whitehouse, D.L, Golebiowski, A, Ji, M, Zhang, M, Beckett, P, Sheeler, R, Andreoli, M, Conway, B, Mahboubi, K, Schroeter, H, Van Zandt, M.C, Podjarny, A. 登録日 2012-11-15 公開日 2013-03-20 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.602 Å) 主引用文献 Discovery of (R)-2-Amino-6-borono-2-(2-(piperidin-1-yl)ethyl)hexanoic Acid and Congeners As Highly Potent Inhibitors of Human Arginases I and II for Treatment of Myocardial Reperfusion Injury. J.Med.Chem., 56, 2013
4I38	Structures of IT intermediates from time-resolved laue crystallography collected at 14ID-B, APS 分子名称: 4'-HYDROXYCINNAMIC ACID, Photoactive yellow protein 著者 Jung, Y.O, Lee, J.H, Kim, J, Schmidt, M, Vukica, S, Moffat, K, Ihee, H. 登録日 2012-11-26 公開日 2013-03-20 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Volume-conserving trans-cis isomerization pathways in photoactive yellow protein visualized by picosecond X-ray crystallography NAT.CHEM., 5, 2013
4I3I	Structures of IT intermediate of photoactive yellow protein E46Q mutant from time-resolved laue crystallography collected at 14ID APS 分子名称: 4'-HYDROXYCINNAMIC ACID, Photoactive yellow protein 著者 Jung, Y.O, Lee, J.H, Kim, J, Schmidt, M, Vukica, S, Moffat, K, Ihee, H. 登録日 2012-11-26 公開日 2013-03-20 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Volume-conserving trans-cis isomerization pathways in photoactive yellow protein visualized by picosecond X-ray crystallography NAT.CHEM., 5, 2013
4I9U	Crystal structure of rabbit LDHA in complex with a fragment inhibitor AP26256 分子名称: 6-({2-[(5-chloro-2-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)pyridine-3-carboxylic acid, L-lactate dehydrogenase A chain 著者 Zhou, T, Kohlmann, A, Stephan, Z.G, Commodore, L, Greenfield, M.T, Zhu, X, Dalgarno, D.C. 登録日 2012-12-05 公開日 2013-01-23 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Fragment growing and linking lead to novel nanomolar lactate dehydrogenase inhibitors. J.Med.Chem., 56, 2013
6ZUG	Crystal Structure of Thrombin in complex with compound10 分子名称: 2-[(3-chlorophenyl)methylamino]-7-methoxy-~{N}-[[(3~{S})-oxolan-3-yl]methyl]-~{N}-propyl-1,3-benzoxazole-5-carboxamide, 2-acetamido-2-deoxy-beta-D-glucopyranose, Hirudin-2, ... 著者 Schafer, M. 登録日 2020-07-22 公開日 2020-08-26 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Design, Synthesis, and Pharmacological Characterization of a Neutral, Non-Prodrug Thrombin Inhibitor with Good Oral Pharmacokinetics. J.Med.Chem., 63, 2020
4IBP	Crystal structure of a glutathione transferase family member from Pseudomonas fluorescens Pf-5, target EFI-900011, with bound glutathione 分子名称: GLUTATHIONE, Glutathione S-transferase-like protein YibF, SULFATE ION 著者 Vetting, M.W, Sauder, J.M, Morisco, L.L, Wasserman, S.R, Sojitra, S, Imker, H.J, Burley, S.K, Gerlt, J.A, Almo, S.C, Enzyme Function Initiative (EFI) 登録日 2012-12-09 公開日 2012-12-26 最終更新日 2023-12-06 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Crystal structure of a glutathione transferase family member from Pseudomonas fluorescens Pf-5, target IFI-900011, with bound glutathione To be Published
4ID0	Crystal structure of a glutathione transferase family member from Pseudomonas fluorescens Pf-5, target EFI-900011, with bound glutathione sulfinic acid (gso2h) and acetate 分子名称: ACETATE ION, GLYCEROL, Glutathione S-transferase-like protein YibF, ... 著者 Vetting, M.W, Sauder, J.M, Morisco, L.L, Wasserman, S.R, Sojitra, S, Imker, H.J, Burley, S.K, Gerlt, J.A, Almo, S.C, Enzyme Function Initiative (EFI) 登録日 2012-12-11 公開日 2012-12-26 最終更新日 2023-12-06 実験手法 X-RAY DIFFRACTION (1.1 Å) 主引用文献 Crystal structure of a glutathione transferase family member from Pseudomonas fluorescens Pf-5, target EFI-900011, with bound glutathione sulfinic acid (gso2h) and acetate To be Published
4IFQ	Crystal structure of Saccharomyces cerevisiae NUP192, residues 2 to 960 [ScNup192(2-960)] 分子名称: IODIDE ION, Nucleoporin NUP192, SULFATE ION 著者 Sampathkumar, P, Almo, S.C, New York Structural Genomics Research Consortium (NYSGRC), Nucleocytoplasmic Transport: a Target for Cellular Control (NPCXstals) 登録日 2012-12-14 公開日 2013-02-20 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (3.25 Å) 主引用文献 Structure, dynamics, evolution, and function of a major scaffold component in the nuclear pore complex. Structure, 21, 2013
5PO8	PanDDA analysis group deposition -- Crystal Structure of BRD1 in complex with N07808b 分子名称: 1,2-ETHANEDIOL, 6-amino-1-methyl-3,4-dihydroquinolin-2(1H)-one, Bromodomain-containing protein 1, ... 著者 Pearce, N.M, Krojer, T, Talon, R, Bradley, A.R, Fairhead, M, Sethi, R, Wright, N, MacLean, E, Collins, P, Brandao-Neto, J, Douangamath, A, Renjie, Z, Dias, A, Ng, J, Brennan, P.E, Cox, O, Bountra, C, Arrowsmith, C.H, Edwards, A, von Delft, F. 登録日 2017-02-07 公開日 2017-03-15 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 A multi-crystal method for extracting obscured crystallographic states from conventionally uninterpretable electron density. Nat Commun, 8, 2017
4IJV	Crystal structure of 11b-HSD1 double mutant (L262R, F278E) in complex with 3-[1-(4-chlorophenyl)cyclopropyl]-8-(2-fluorophenoxy)[1,2,4]triazolo[4,3-a]pyridine 分子名称: 3-[1-(4-chlorophenyl)cyclopropyl]-8-(2-fluorophenoxy)[1,2,4]triazolo[4,3-a]pyridine, Corticosteroid 11-beta-dehydrogenase isozyme 1, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE 著者 Sheriff, S. 登録日 2012-12-23 公開日 2014-06-11 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.35 Å) 主引用文献 Optimization of 1,2,4-Triazolopyridines as Inhibitors of Human 11 beta-Hydroxysteroid Dehydrogenase Type 1 (11 beta-HSD-1). ACS Med Chem Lett, 5, 2014
4IWQ	Crystal structure and mechanism of activation of TBK1 分子名称: N-{3-[(5-cyclopropyl-2-{[3-(morpholin-4-ylmethyl)phenyl]amino}pyrimidin-4-yl)amino]propyl}cyclobutanecarboxamide, Serine/threonine-protein kinase TBK1 著者 Panne, D, Larabi, A. 登録日 2013-01-24 公開日 2013-03-13 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 Crystal structure and mechanism of activation of TANK-binding kinase 1. Cell Rep, 3, 2013
4IUF	Crystal Structure of Human TDP-43 RRM1 Domain in Complex with a Single-stranded DNA 分子名称: 5'-D(*GP*TP*TP*GP*(XUA)P*GP*CP*GP*T)-3', TAR DNA-binding protein 43 著者 Kuo, P.H, Doudeva, L.G, Wang, Y.T, Yang, W.Z, Yuan, H.S. 登録日 2013-01-21 公開日 2014-01-29 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.752 Å) 主引用文献 The crystal structure of TDP-43 RRM1-DNA complex reveals the specific recognition for UG- and TG-rich nucleic acids. Nucleic Acids Res., 42, 2014
4IWO	Crystal structure and mechanism of activation of TBK1 分子名称: N-{3-[(5-cyclopropyl-2-{[3-(2-oxopyrrolidin-1-yl)phenyl]amino}pyrimidin-4-yl)amino]propyl}cyclobutanecarboxamide, Serine/threonine-protein kinase TBK1 著者 Panne, D, Larabi, A. 登録日 2013-01-24 公開日 2013-03-13 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.61 Å) 主引用文献 Crystal structure and mechanism of activation of TANK-binding kinase 1. Cell Rep, 3, 2013
4J1L	Mutant Endotoxin TeNT 分子名称: Tetanus toxin, ZINC ION 著者 Guo, J, Pan, X, Zhao, Y, Chen, S. 登録日 2013-02-01 公開日 2014-02-05 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Engineering Clostridia Neurotoxins with elevated catalytic activity Toxicon, 74, 2013
4IS7	Crystal Structure of the CASKIN2 SAM Domain Tandem 分子名称: Caskin-2 著者 Donaldson, L.W, Kwan, J.J. 登録日 2013-01-16 公開日 2014-02-05 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.751 Å) 主引用文献 Crystal Structure of the CASKIN2 SAM Domain Tandem To be Published
4J36	Cocrystal Structure of kynurenine 3-monooxygenase in complex with UPF 648 inhibitor(KMO-394UPF) 分子名称: (1S,2S)-2-(3,4-dichlorobenzoyl)cyclopropanecarboxylic acid, FLAVIN-ADENINE DINUCLEOTIDE, Kynurenine 3-monooxygenase 著者 Amaral, M, Levy, C, Heyes, D.J, Lafite, P, Outeiro, T.F, Giorgini, F, Leys, D, Scrutton, N.S. 登録日 2013-02-05 公開日 2013-04-10 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.13 Å) 主引用文献 Structural basis of kynurenine 3-monooxygenase inhibition. Nature, 496, 2013
4GE5	Crystal structure of human protein tyrosine phosphatase PTPN9 (MEG2) complex with compound 5 分子名称: N-(4-bromo-3-methylbenzoyl)-4-[difluoro(phosphono)methyl]-L-phenylalanyl-N~5~-(3-iodobenzoyl)-L-ornithinamide, Tyrosine-protein phosphatase non-receptor type 9 著者 Zhang, Z.-Y, Liu, S, Zhang, S. 登録日 2012-08-01 公開日 2012-10-31 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 A Highly Selective and Potent PTP-MEG2 Inhibitor with Therapeutic Potential for Type 2 Diabetes. J.Am.Chem.Soc., 134, 2012
4FXM	Crystal structure of the complex of a human telomeric repeat G-quadruplex and N-methyl mesoporphyrin IX (P21212) 分子名称: DNA (5'-D(*AP*GP*GP*GP*TP*TP*AP*GP*GP*GP*TP*TP*AP*GP*GP*GP*TP*TP*AP*GP*GP*G)-3'), N-METHYLMESOPORPHYRIN, POTASSIUM ION 著者 Nicoludis, J.M, Miller, S.T, Jeffrey, P, Lawton, T.J, Rosenzweig, A.C, Yatsunyk, L.A. 登録日 2012-07-03 公開日 2012-12-26 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.651 Å) 主引用文献 Optimized End-Stacking Provides Specificity of N-Methyl Mesoporphyrin IX for Human Telomeric G-Quadruplex DNA. J.Am.Chem.Soc., 134, 2012
4G1N	PKM2 in complex with an activator 分子名称: MAGNESIUM ION, N-(4-{[4-(pyrazin-2-yl)piperazin-1-yl]carbonyl}phenyl)quinoline-8-sulfonamide, OXALATE ION, ... 著者 Kung, C, Hixon, J, Dang, L, DeLaBarre, B, Qian, K.C. 登録日 2012-07-10 公開日 2012-10-10 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Small Molecule Activation of PKM2 in Cancer Cells Induces Serine Auxotrophy. Chem.Biol., 19, 2012

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