PDB: 217477 件ウェブページステータス検索Chemie searchBIRD

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1A1N	MHC CLASS I MOLECULE B*3501 COMPLEXED WITH PEPTIDE VPLRPMTY FROM THE NEF PROTEIN (75-82) OF HIV1 分子名称: Beta-2-microglobulin, HLA class I histocompatibility antigen, BW-53 B*5301 alpha chain, ... 著者 Smith, K.J, Reid, S.W, Stuart, D.I, Mcmichael, A.J, Jones, E.Y, Bell, J.I. 登録日 1997-12-11 公開日 1998-04-08 最終更新日 2023-08-02 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 An altered position of the alpha 2 helix of MHC class I is revealed by the crystal structure of HLA-B*3501. Immunity, 4, 1996
3UP8	Crystal structure of a putative 2,5-diketo-D-gluconic acid reductase B 分子名称: ACETATE ION, Putative 2,5-diketo-D-gluconic acid reductase B 著者 Eswaramoorthy, S, Chamala, S, Evans, B, Foti, R, Gizzi, A, Hillerich, B, Kar, A, LaFleur, J, Seidel, R, Villigas, G, Zencheck, W, Almo, S.C, Swaminathan, S, New York Structural Genomics Research Consortium (NYSGRC) 登録日 2011-11-17 公開日 2011-12-14 最終更新日 2023-12-06 実験手法 X-RAY DIFFRACTION (1.96 Å) 主引用文献 Crystal structure of a putative 2,5-diketo-D-gluconic acid reductase B To be Published
4MQT	Structure of active human M2 muscarinic acetylcholine receptor bound to the agonist iperoxo and allosteric modulator LY2119620 分子名称: 3-amino-5-chloro-N-cyclopropyl-4-methyl-6-[2-(4-methylpiperazin-1-yl)-2-oxoethoxy]thieno[2,3-b]pyridine-2-carboxamide, 4-(4,5-dihydro-1,2-oxazol-3-yloxy)-N,N,N-trimethylbut-2-yn-1-aminium, Muscarinic acetylcholine receptor M2, ... 著者 Kruse, A.C, Ring, A.M, Manglik, A, Hu, J, Hu, K, Eitel, K, Huebner, H, Pardon, E, Valant, C, Sexton, P.M, Christopoulos, A, Felder, C.C, Gmeiner, P, Steyaert, J, Weis, W.I, Garcia, K.C, Wess, J, Kobilka, B.K. 登録日 2013-09-16 公開日 2013-11-27 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (3.7 Å) 主引用文献 Activation and allosteric modulation of a muscarinic acetylcholine receptor. Nature, 504, 2013
1MQZ	NMR solution structure of type-B lantibiotics mersacidin bound to lipid II in DPC micelles 分子名称: LANTIBIOTIC MERSACIDIN 著者 Hsu, S.-T, Breukink, E, Bierbaum, G, Sahl, H.-G, de Kruijff, B, Kaptein, R, van Nuland, N.A, Bonvin, A.M. 登録日 2002-09-17 公開日 2003-03-11 最終更新日 2024-07-10 実験手法 SOLUTION NMR 主引用文献 NMR Study of Mersacidin and Lipid II Interaction in Dodecylphosphocholine Micelles. Conformational Changes are a Key to Antimicrobial Activity J.Biol.Chem., 278, 2003
1MQY	NMR solution structure of type-B lantibiotics mersacidin in DPC micelles 分子名称: LANTIBIOTIC MERSACIDIN 著者 Hsu, S.-T, Breukink, E, Bierbaum, G, Sahl, H.-G, de Kruijff, B, Kaptein, R, van Nuland, N.A, Bonvin, A.M. 登録日 2002-09-17 公開日 2003-03-11 最終更新日 2024-07-10 実験手法 SOLUTION NMR 主引用文献 NMR Study of Mersacidin and Lipid II Interaction in Dodecylphosphocholine Micelles. Conformational Changes are a Key to Antimicrobial Activity J.Biol.Chem., 278, 2003
2BGA	Bacillus cereus metallo-beta-lactamase (BcII) Arg (121) Cys mutant. Solved at pH7 using 20 Micromolar ZnSO4 in the buffer. 1mM DTT was used as a reducing agent. Cys221 is oxidized. 分子名称: AZIDE ION, BETA-LACTAMASE II, GLYCEROL, ... 著者 Davies, A.M, Rasia, R.M, Vila, A.J, Sutton, B.J, Fabiane, S.M. 登録日 2004-12-17 公開日 2005-03-31 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Effect of Ph on the Active Site of an Arg121Cys Mutant of the Metallo-Beta-Lactamase from Bacillus Cereus: Implications for the Enzyme Mechanism Biochemistry, 44, 2005
3LJ3	PI3-kinase-gamma with a pyrrolopyridine-benzofuran inhibitor 分子名称: (2Z)-4,6-dihydroxy-2-{[1-methyl-4-(4-methylpiperazin-1-yl)-1H-pyrrolo[2,3-b]pyridin-3-yl]methylidene}-1-benzofuran-3(2H)-one, Phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, SULFATE ION 著者 Bard, J, Svenson, K. 登録日 2010-01-25 公開日 2010-04-14 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2.43 Å) 主引用文献 Discovery and optimization of 2-(4-substituted-pyrrolo[2,3-b]pyridin-3-yl)methylene-4-hydroxybenzofuran-3(2H)-ones as potent and selective ATP-competitive inhibitors of the mammalian target of rapamycin (mTOR). Bioorg.Med.Chem.Lett., 20, 2010
1Q3W	GSK-3 Beta complexed with Alsterpaullone 分子名称: 9-NITRO-5,12-DIHYDRO-7H-BENZO[2,3]AZEPINO[4,5-B]INDOL-6-ONE, GLYCOGEN SYNTHASE KINASE-3 BETA 著者 Bertrand, J.A, Thieffine, S, Vulpetti, A, Cristiani, C, Valsasina, B, Knapp, S, Kalisz, H.M, Flocco, M. 登録日 2003-08-01 公開日 2003-10-21 最終更新日 2023-08-16 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Structural Characterization of the Gsk-3Beta Active Site Using Selective and Non-selective ATP-Mimetic Inhibitors J.Mol.Biol., 333, 2003
3C3D	Crystal structure of 2-phospho-(S)-lactate transferase from Methanosarcina mazei in complex with Fo and phosphate. Northeast Structural Genomics Consortium target MaR46 分子名称: 1-deoxy-1-(8-hydroxy-2,4-dioxo-3,4-dihydropyrimido[4,5-b]quinolin-10(2H)-yl)-D-ribitol, 2-phospho-L-lactate transferase, PHOSPHATE ION 著者 Forouhar, F, Abashidze, M, Xu, H, Grochowski, L.L, Seetharaman, J, Hussain, M, Kuzin, A.P, Chen, Y, Zhou, W, Xiao, R, Acton, T.B, Montelione, G.T, Galinier, A, White, R.H, Tong, L, Northeast Structural Genomics Consortium (NESG) 登録日 2008-01-28 公開日 2008-02-19 最終更新日 2011-07-13 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Molecular insights into the biosynthesis of the f420 coenzyme. J.Biol.Chem., 283, 2008
3HKU	Human carbonic anhydrase II in complex with topiramate 分子名称: Carbonic anhydrase 2, ZINC ION, [(3aS,5aR,8aR,8bS)-2,2,7,7-tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-3a-yl]methyl sulfamate 著者 Paul, B, Poulsen, S.-A, Hofmann, A. 登録日 2009-05-25 公開日 2009-10-13 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 S-glycosyl primary sulfonamides--a new structural class for selective inhibition of cancer-associated carbonic anhydrases. J.Med.Chem., 52, 2009
1ZX4	Structure of ParB bound to DNA 分子名称: CITRIC ACID, Plasmid Partition par B protein, parS-small DNA centromere site 著者 Schumacher, M.A, Funnell, B.E. 登録日 2005-06-06 公開日 2005-11-29 最終更新日 2017-10-04 実験手法 X-RAY DIFFRACTION (2.98 Å) 主引用文献 Structures of ParB bound to DNA reveal mechanism of partition complex formation. Nature, 438, 2005
2Q85	Crystal Structure of E. Coli Mur B bound to a Naphthyl Tetronic Acid inihibitor 分子名称: (5Z)-3-(4-CHLOROPHENYL)-4-HYDROXY-5-(1-NAPHTHYLMETHYLENE)FURAN-2(5H)-ONE, FLAVIN-ADENINE DINUCLEOTIDE, UDP-N-acetylenolpyruvoylglucosamine reductase 著者 Chopra, R, Bard, J, Svenson, K, Mansour, T. 登録日 2007-06-08 公開日 2007-06-26 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (2.51 Å) 主引用文献 Crystal Structure of E. Coli Mur B bound to a napthyl tetronic acid inhibitor TO BE PUBLISHED
4NOX	Structure of the nine-bladed beta-propeller of eIF3b 分子名称: CHLORIDE ION, Eukaryotic translation initiation factor 3 subunit B 著者 Liu, Y, Neumann, P, Kuhle, B, Monecke, T, Ficner, R. 登録日 2013-11-20 公開日 2014-09-17 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.722 Å) 主引用文献 Translation initiation factor eIF3b contains a nine-bladed beta-propeller and interacts with the 40S ribosomal subunit Structure, 22, 2014
4IDT	Crystal Structure of NIK with 11-bromo-5,6,7,8-tetrahydropyrimido[4',5':3,4]cyclohepta[1,2-b]indol-2-amine (T28) 分子名称: 11-bromo-5,6,7,8-tetrahydropyrimido[4',5':3,4]cyclohepta[1,2-b]indol-2-amine, Mitogen-activated protein kinase kinase kinase 14 著者 Liu, J, Sudom, A, Wang, Z. 登録日 2012-12-13 公開日 2013-04-17 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Inhibiting NF-KB-inducing kinase (NIK): Discovery, structure-based design, synthesis, structure activity relationship, and co-crystal structures Bioorg.Med.Chem.Lett., 23, 2013
3TTO	Crystal structure of Leuconostoc mesenteroides NRRL B-1299 N-terminally truncated dextransucrase DSR-E in triclinic form 分子名称: CALCIUM ION, Dextransucrase, GLYCEROL 著者 Brison, Y, Pijning, T, Fabre, E, Mourey, L, Morel, S, Potocki-Veronese, G, Monsan, P, Tranier, S, Remaud-Simeon, M, Dijkstra, B.W. 登録日 2011-09-15 公開日 2012-01-25 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (3.3 Å) 主引用文献 Functional and structural characterization of alpha-(1-2) branching sucrase derived from DSR-E glucansucrase J.Biol.Chem., 287, 2012
2WTW	Aurora-A Inhibitor Structure (2nd crystal form) 分子名称: 4-{[9-CHLORO-7-(2,6-DIFLUOROPHENYL)-5H-PYRIMIDO[5,4-D][2]BENZAZEPIN-2-YL]AMINO}BENZOIC ACID, SERINE/THREONINE-PROTEIN KINASE 6 AURORA/IPL1-RELATED KINASE 1, BREAST TUMOR-AMPLIFIED KINASE, ... 著者 Kosmopoulou, M, Bayliss, R. 登録日 2009-09-24 公開日 2010-01-26 最終更新日 2023-12-20 実験手法 X-RAY DIFFRACTION (3.302 Å) 主引用文献 Crystal Structure of an Aurora-A Mutant that Mimics Aurora-B Bound to Mln8054: Insights Into Selectivity and Drug Design. Biochem.J., 427, 2010
1Q9D	Fructose-1,6-bisphosphatase Complexed with a New Allosteric Site Inhibitor (I-State) 分子名称: 3-(4-HYDROXYBENZYL)-2-[1-({[2-(4-HYDROXYPHENYL)ETHYL]AMINO}CARBONYL)BUTYL]-4-OXO-3,6,11,11A-TETRAHYDRO-4H-PYRAZINO[1,2-B]ISOQUINOLIN-2-IUM-1-OLATE, 6-O-phosphono-beta-D-fructofuranose, Fructose-1,6-bisphosphatase, ... 著者 Honzatko, R.B, Choe, J.Y. 登録日 2003-08-25 公開日 2003-12-02 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (2.35 Å) 主引用文献 Inhibition of fructose-1,6-bisphosphatase by a new class of allosteric effectors J.Biol.Chem., 278, 2003
2GUM	Crystal structure of the extracellular domain of glycoprotein B from Herpes Simplex Virus type I 分子名称: Glycoprotein B, SODIUM ION 著者 Heldwein, E.E. 登録日 2006-05-01 公開日 2006-07-25 最終更新日 2017-10-18 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Crystal structure of glycoprotein B from herpes simplex virus 1. Science, 313, 2006
1P84	HDBT inhibited Yeast Cytochrome bc1 Complex 分子名称: 1,2-DIACYL-GLYCEROL-3-SN-PHOSPHATE, 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 1,2-Distearoyl-sn-glycerophosphoethanolamine, ... 著者 Palsdottir, H, Lojero, C.G, Trumpower, B.L, Hunte, C. 登録日 2003-05-06 公開日 2003-07-29 最終更新日 2023-08-16 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Structure of the yeast cytochrome bc1 complex with a hydroxyquinone anion Qo site inhibitor bound J.Biol.Chem., 278, 2003
3D5M	Crystal structure of HCV NS5B polymerase with a novel pyridazinone inhibitor 分子名称: N-({3-[(5S)-5-tert-butyl-1-(3-chloro-4-fluorobenzyl)-4-hydroxy-2-oxo-2,5-dihydro-1H-pyrrol-3-yl]-1,1-dioxido-1,2-benzis othiazol-7-yl}methyl)methanesulfonamide, RNA-directed RNA polymerase 著者 Zhao, Q, Showalter, R.E, Han, Q, Kissinger, C.R. 登録日 2008-05-16 公開日 2009-05-19 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Structure-based design, synthesis, and biological evaluation of 1,1-dioxoisothiazole and benzo[b]thiophene-1,1-dioxide derivatives as novel inhibitors of hepatitis C virus NS5B polymerase. Bioorg.Med.Chem.Lett., 18, 2008
2NUN	The structure of the type III effector AvrB complexed with ADP 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ADENOSINE-5'-DIPHOSPHATE, Avirulence B protein 著者 Singer, A.U, Desveaux, D, Wu, A.J, McNulty, B, Dangl, J.L, Sondek, J. 登録日 2006-11-09 公開日 2007-05-22 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Type III Effector Activation via Nucleotide Binding, Phosphorylation, and Host Target Interaction. Plos Pathog., 3, 2007
3D28	Crystal structure of hcv ns5b polymerase with a novel benzisothiazole inhibitor 分子名称: (5S)-1-benzyl-3-(1,1-dioxido-1,2-benzisothiazol-3-yl)-4-hydroxy-5-(1-methylethyl)-1,5-dihydro-2H-pyrrol-2-one, RNA-directed RNA polymerase 著者 Han, Q, Showalter, R.E, Zhao, Q, Kissinger, C.R. 登録日 2008-05-07 公開日 2009-05-19 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Structure-based design, synthesis, and biological evaluation of 1,1-dioxoisothiazole and benzo[b]thiophene-1,1-dioxide derivatives as novel inhibitors of hepatitis C virus NS5B polymerase. Bioorg.Med.Chem.Lett., 18, 2008
2OF2	crystal structure of furanopyrimidine 8 bound to lck 分子名称: 2,3-DIPHENYL-N-(2-PIPERAZIN-1-YLETHYL)FURO[2,3-B]PYRIDIN-4-AMINE, Proto-oncogene tyrosine-protein kinase LCK 著者 Martin, M.W. 登録日 2007-01-02 公開日 2007-02-27 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Discovery of novel 2,3-diarylfuro[2,3-b]pyridin-4-amines as potent and selective inhibitors of Lck: Synthesis, SAR, and pharmacokinetic properties. Bioorg.Med.Chem.Lett., 17, 2007
1DLE	FACTOR B SERINE PROTEASE DOMAIN 分子名称: COMPLEMENT FACTOR B 著者 Jing, H, Xu, Y, Carson, M, Moore, D, Macon, K.J, Volanakis, J.E, Narayana, S.V. 登録日 1999-12-09 公開日 2000-12-13 最終更新日 2019-11-13 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 New structural motifs on the chymotrypsin fold and their potential roles in complement factor B. EMBO J., 19, 2000
1VTQ	THREE-DIMENSIONAL STRUCTURE OF YEAST T-RNA-ASP. I. STRUCTURE DETERMINATION 分子名称: T-RNA-ASP 著者 Comarmond, M.B, Giege, R, Thierry, J.C, Moras, D, Fischer, J. 登録日 1985-06-11 公開日 2011-07-13 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 Three-Dimensional Structure of Yeast T-RNA-ASP. I. Structure Determination Acta Crystallogr.,Sect.B, 42, 1986

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