PDB: 71589 件ウェブページステータス検索Chemie searchBIRD

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2GHG	h-CHK1 complexed with A431994 分子名称: 5-{5-[(S)-2-AMINO-3-(1H-INDOL-3-YL)-PROPOXYL]-PYRIDIN-3-YL}-3-[1-(1H-PYRROL-2-YL)-METH-(Z)-YLIDENE]-1,3-DIHYDRO-INDOL-2-ONE, Serine/threonine-protein kinase Chk1 著者 Park, C. 登録日 2006-03-27 公開日 2007-03-27 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (3.5 Å) 主引用文献 Discovery and SAR of oxindole-pyridine-based protein kinase B/Akt inhibitors for treating cancers. Bioorg.Med.Chem.Lett., 16, 2006
5I3V	Crystal structure of BACE1 in complex with aminoquinoline compound 1 分子名称: (2R)-3-[2-amino-6-(3-methylpyridin-2-yl)quinolin-3-yl]-N-(3,3-dimethylbutyl)-2-methylpropanamide, Beta-secretase 1, GLYCEROL, ... 著者 Whittington, D.A, Long, A.M. 登録日 2016-02-11 公開日 2016-03-30 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.62 Å) 主引用文献 Fragment-Linking Approach Using (19)F NMR Spectroscopy To Obtain Highly Potent and Selective Inhibitors of beta-Secretase. J.Med.Chem., 59, 2016
4ED9	Crystal structure of a CAIB/BAIF family protein from Brucella suis 分子名称: 1,2-ETHANEDIOL, 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, CAIB/BAIF family protein, ... 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2012-03-27 公開日 2012-04-25 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Crystal structure of a CAIB/BAIF family protein from Brucella suis To be Published
4W8E	Structure of MST3 with a pyrrolopyrimidine inhibitor (PF-06645342) 分子名称: 3-{4-[(2R)-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-5-yl}benzonitrile, Serine/threonine-protein kinase 24 36 kDa subunit 著者 Jasti, J, Song, X, Griffor, M, Kurumbail, R.G. 登録日 2014-08-24 公開日 2015-03-18 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.79 Å) 主引用文献 Discovery and preclinical profiling of 3-[4-(morpholin-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile (PF-06447475), a highly potent, selective, brain penetrant, and in vivo active LRRK2 kinase inhibitor. J.Med.Chem., 58, 2015
4W8D	Crystal structure of MST3 with a pyrrolopyrimidine inhibitor (PF-06454589). 分子名称: 5-(1-methyl-1H-pyrazol-4-yl)-4-(morpholin-4-yl)-7H-pyrrolo[2,3-d]pyrimidine, Serine/threonine-protein kinase 24 36 kDa subunit 著者 Jasti, J, Song, X, Griffor, M, Kurumbail, R.G. 登録日 2014-08-24 公開日 2015-03-18 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.77 Å) 主引用文献 Discovery and preclinical profiling of 3-[4-(morpholin-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile (PF-06447475), a highly potent, selective, brain penetrant, and in vivo active LRRK2 kinase inhibitor. J.Med.Chem., 58, 2015
3M1N	Crystal structure of Human Sonic Hedgehog N-terminal domain 分子名称: SULFATE ION, Sonic hedgehog protein, ZINC ION 著者 Boriack-Sjodin, P.A, Pepinsky, R.B, Garber, E.A, Silvian, L.F. 登録日 2010-03-05 公開日 2010-03-16 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Mapping sonic hedgehog-receptor interactions by steric interference. J.Biol.Chem., 275, 2000
7ZI0	Structure of human Smoothened in complex with cholesterol and SAG 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 3-chloro-N-[trans-4-(methylamino)cyclohexyl]-N-{[3-(pyridin-4-yl)phenyl]methyl}-1-benzothiophene-2-carboxamide, CHOLESTEROL, ... 著者 Byrne, E.F.X, Woolley, R.E, Ansell, B, Sansom, M.S.P, Newstead, S, Siebold, C. 登録日 2022-04-07 公開日 2022-06-15 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 Patched 1 regulates Smoothened by controlling sterol binding to its extracellular cysteine-rich domain. Sci Adv, 8, 2022
4WBQ	Crystal structure of the exonuclease domain of QIP (QDE-2 interacting protein) solved by native-SAD phasing. 分子名称: CALCIUM ION, QDE-2-interacting protein 著者 Boland, A, Weinert, T, Weichenrieder, O, Wang, M. 登録日 2014-09-03 公開日 2014-12-10 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2.693 Å) 主引用文献 Fast native-SAD phasing for routine macromolecular structure determination. Nat.Methods, 12, 2015
3M1C	Crystal structure of the conserved herpesvirus fusion regulator complex gH-gL 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, Envelope glycoprotein H, ... 著者 Chowdary, T.K, Heldwein, E.E. 登録日 2010-03-04 公開日 2010-07-07 最終更新日 2020-07-29 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 Crystal structure of the conserved herpesvirus fusion regulator complex gH-gL. Nat.Struct.Mol.Biol., 17, 2010
2GYR	Crystal structure of human artemin 分子名称: Neurotrophic factor artemin, isoform 3 著者 Wang, X.Q. 登録日 2006-05-09 公開日 2006-06-27 最終更新日 2011-07-13 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Structure of Artemin Complexed with Its Receptor GFRalpha3: Convergent Recognition of Glial Cell Line-Derived Neurotrophic Factors. Structure, 14, 2006
4UX6	The discovery of novel, potent and highly selective inhibitors of inducible nitric oxide synthase (iNOS) 分子名称: 5,6,7,8-TETRAHYDROBIOPTERIN, NITRIC OXIDE SYNTHASE, INDUCIBLE, ... 著者 Cheshire, D.R, Andrews, G, Beaton, H.G, Birkinshaw, T, Boughton-Smith, N, Connolly, S, Cook, T.R, Cooper, A, Cooper, S.L, Cox, D, Dixon, J, Gensmantel, N, Hamley, P.J, Harrison, R, Hartopp, P, Kack, H, Luker, T, Mete, A, Millichip, I, Nicholls, D.J, Pimm, A.D, St-Gallay, S.A, Wallace, A.V. 登録日 2014-08-19 公開日 2014-10-08 最終更新日 2018-01-17 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 The Discovery of Novel, Potent and Highly Selective Inhibitors of Inducible Nitric Oxide Synthase (Inos). Bioorg.Med.Chem.Lett., 21, 2011
3MD7	Crystal structure of a beta-lactamase-like protein bound to GMP from brucella melitensis 分子名称: Beta-lactamase-like, GUANOSINE-5'-MONOPHOSPHATE, L(+)-TARTARIC ACID, ... 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2010-03-30 公開日 2010-04-21 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.27 Å) 主引用文献 BrabA.11339.a: anomalous diffraction and ligand binding guide towards the elucidation of the function of a `putative beta-lactamase-like protein from Brucella melitensis. Acta Crystallogr.,Sect.F, 67, 2011
4UV0	Structure of a semisynthetic phosphorylated DAPK 分子名称: DEATH-ASSOCIATED PROTEIN KINASE 1, TRIETHYLENE GLYCOL 著者 de Diego, I, Rios, P, Meyer, C, Koehn, M, Wilmanns, M. 登録日 2014-08-01 公開日 2015-08-12 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.49 Å) 主引用文献 Molecular Mechanisms Behind Dapk Regulation: How the Phosphorylation Activity Switch Works To be Published
7ZYH	Crystal structure of human CPSF30 in complex with hFip1 分子名称: Cleavage and polyadenylation specificity factor subunit 4, Isoform 4 of Pre-mRNA 3'-end-processing factor FIP1, ZINC ION 著者 Muckenfuss, L.M, Jinek, M, Migenda Herranz, A.C, Clerici, M. 登録日 2022-05-24 公開日 2022-09-14 最終更新日 2024-06-19 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Fip1 is a multivalent interaction scaffold for processing factors in human mRNA 3' end biogenesis. Elife, 11, 2022
5IR4	Crystal structure of wild-type bacterial lipoxygenase from Pseudomonas aeruginosa PA-LOX with space group C2221 at 1.48 A resolution 分子名称: (2R)-3-{[(S)-(2-aminoethoxy)(hydroxy)phosphoryl]oxy}-2-(tetradec-5-enoyloxy)propyl (11Z)-octadec-11-enoate, Arachidonate 15-lipoxygenase, CHLORIDE ION, ... 著者 Kalms, J, Banthiya, S, Galemou Yoga, E, Kuhn, H, Scheerer, P. 登録日 2016-03-12 公開日 2016-08-10 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.48 Å) 主引用文献 Structural and functional basis of phospholipid oxygenase activity of bacterial lipoxygenase from Pseudomonas aeruginosa. Biochim.Biophys.Acta, 1861, 2016
5IM3	Crystal structure of the class I ribonucleotide reductase from Pseudomonas aeruginosa in complex with dATP 分子名称: 2'-DEOXYADENOSINE 5'-TRIPHOSPHATE, MAGNESIUM ION, Ribonucleoside-diphosphate reductase 著者 Johansson, R, Logan, D.T. 登録日 2016-03-05 公開日 2016-05-04 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.298 Å) 主引用文献 Structural Mechanism of Allosteric Activity Regulation in a Ribonucleotide Reductase with Double ATP Cones. Structure, 24, 2016
5I3X	Crystal structure of BACE1 in complex with aminoquinoline inhibitor 6 分子名称: Beta-secretase 1, GLYCEROL, N-(1-{3-[2-(2-amino-3-{3-[(3,3-dimethylbutyl)amino]-3-oxopropyl}quinolin-6-yl)phenyl]prop-2-yn-1-yl}cyclopropyl)-4-fluorobenzamide 著者 Whittington, D.A, Long, A.M. 登録日 2016-02-11 公開日 2016-03-30 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Fragment-Linking Approach Using (19)F NMR Spectroscopy To Obtain Highly Potent and Selective Inhibitors of beta-Secretase. J.Med.Chem., 59, 2016
7ZY4	Crystal structure of human CstF77 in complex with hFip1 分子名称: Cleavage stimulation factor subunit 3, GLYCEROL, hFip1 著者 Muckenfuss, L.M, Jinek, M. 登録日 2022-05-23 公開日 2022-09-14 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (2.55 Å) 主引用文献 Fip1 is a multivalent interaction scaffold for processing factors in human mRNA 3' end biogenesis. Elife, 11, 2022
4V47	Real space refined coordinates of the 30S and 50S subunits fitted into the low resolution cryo-EM map of the EF-G.GTP state of E. coli 70S ribosome 分子名称: 16S RIBOSOMAL RNA, 23S ribosomal RNA, 30S RIBOSOMAL PROTEIN S10, ... 著者 Gao, H, Sengupta, J, Valle, M, Korostelev, A, Eswar, N, Stagg, S.M, Van Roey, P, Agrawal, R.K, Harvey, S.T, Sali, A, Chapman, M.S, Frank, J. 登録日 2003-05-06 公開日 2014-07-09 最終更新日 2024-02-28 実験手法 ELECTRON MICROSCOPY (12.3 Å) 主引用文献 Study of the structural dynamics of the E. coli 70S ribosome using real space refinement Cell(Cambridge,Mass.), 113, 2003
4EG0	Crystal Structure of D-alanine--D-alanine ligase from Burkholderia ambifaria 分子名称: 1,2-ETHANEDIOL, D-alanine--D-alanine ligase 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2012-03-30 公開日 2012-05-09 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Combining functional and structural genomics to sample the essential Burkholderia structome. Plos One, 8, 2013
4EGF	Crystal structure of a L-xylulose reductase from Mycobacterium smegmatis 分子名称: L-xylulose reductase 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID), Arakaki, T.L, Staker, B.L, Fairman, J.W. 登録日 2012-03-30 公開日 2012-05-02 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Increasing the structural coverage of tuberculosis drug targets. Tuberculosis (Edinb), 95, 2015
4ED4	Crystal structure of IspE (4-diphosphocytidyl-2-C-methyl-D-erythritol kinase) from Mycobacterium abcessus, bound to ATP 分子名称: 4-diphosphocytidyl-2-C-methyl-D-erythritol kinase, ADENOSINE-5'-TRIPHOSPHATE 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2012-03-26 公開日 2012-04-04 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.75 Å) 主引用文献 Increasing the structural coverage of tuberculosis drug targets. Tuberculosis (Edinb), 95, 2015
4IV6	X-ray crystal structure of an isovaleryl-CoA dehydrogenase from Mycobacterium smegmatis 分子名称: Acyl-CoA dehydrogenase FadE3, DIHYDROFLAVINE-ADENINE DINUCLEOTIDE 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2013-01-22 公開日 2013-03-20 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Increasing the structural coverage of tuberculosis drug targets. Tuberculosis (Edinb), 95, 2015
4DZ4	X-ray crystal structure of a hypothetical Agmatinase from Burkholderia thailandensis 分子名称: 1,2-ETHANEDIOL, Agmatinase, MANGANESE (II) ION, ... 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2012-02-29 公開日 2012-03-28 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Combining functional and structural genomics to sample the essential Burkholderia structome. Plos One, 8, 2013
4DXL	Crystal structure of IspE (4-diphosphocytidyl-2-C-methyl-D-erythritol kinase) from Mycobacterium abscessus, bound to CMP and ATP 分子名称: 4-diphosphocytidyl-2-C-methyl-D-erythritol kinase, ADENOSINE-5'-TRIPHOSPHATE, CHLORIDE ION, ... 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2012-02-27 公開日 2012-03-07 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Increasing the structural coverage of tuberculosis drug targets. Tuberculosis (Edinb), 95, 2015

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