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PDB: 45910 件

5TPC
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BU of 5tpc by Molmil
Binding domain of BoNT/A complexed with ganglioside
分子名称: Botulinum neurotoxin type A, N-acetyl-alpha-neuraminic acid-(2-3)-beta-D-galactopyranose, N-acetyl-alpha-neuraminic acid-(2-3)-beta-D-galactopyranose-(1-3)-2-acetamido-2-deoxy-beta-D-galactopyranose
著者Berntsson, R.P.-A, Svensson, L.M, Stenmark, P.
登録日2016-10-20
公開日2017-01-18
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Glycans Confer Specificity to the Recognition of Ganglioside Receptors by Botulinum Neurotoxin A.
J. Am. Chem. Soc., 139, 2017
3NOI
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Crystal Structure of Natural Killer Cell Cytotoxicity Receptor NKp30 (NCR3)
分子名称: 2-(2-{2-[2-(2-METHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL, CALCIUM ION, Natural cytotoxicity triggering receptor 3
著者Joyce, M.G, Sun, P.D.
登録日2010-06-25
公開日2011-03-30
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (1.842 Å)
主引用文献Structure of the Natural Killer cell activating receptor NKp30 and dissection of ligand binding site
Proc.Natl.Acad.Sci.USA, 2011
6S3C
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BU of 6s3c by Molmil
Fragment AZ-019 binding at the p53pT387/14-3-3 sigma interface
分子名称: 14-3-3 protein sigma, 4-phenyl-5-(piperidin-4-ylmethyl)thiophene-2-carboximidamide, CHLORIDE ION, ...
著者Genet, S, Wolter, M, Guillory, X, Somsen, B, Leysen, S, Castaldi, P, Ottmann, C.
登録日2019-06-25
公開日2020-06-17
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Fragment-based Differential Targeting of PPI Stabilizer Interfaces.
J.Med.Chem., 63, 2020
5X67
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BU of 5x67 by Molmil
Human thymidylate synthase in complex with dUMP and nolatrexed
分子名称: 2'-DEOXYURIDINE 5'-MONOPHOSPHATE, 2-azanyl-6-methyl-5-pyridin-4-ylsulfanyl-3H-quinazolin-4-one, Thymidylate synthase
著者Chen, D, Jansson, A, Larsson, A, Nordlund, P.
登録日2017-02-21
公開日2017-06-28
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.13 Å)
主引用文献Structural analyses of human thymidylate synthase reveal a site that may control conformational switching between active and inactive states.
J. Biol. Chem., 292, 2017
4LTH
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BU of 4lth by Molmil
Dehydration/Rehydration of a Nucleic Acid system containing a Polypyridyl Ruthenium Complex at 97% relative humidity (3/7)
分子名称: BARIUM ION, DNA, Ru(tap)2(dppz) complex
著者Hall, J.P, Sanchez-Weatherby, J, Cardin, C.J.
登録日2013-07-23
公開日2014-09-24
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Controlled Dehydration of a Ruthenium Complex-DNA Crystal Induces Reversible DNA Kinking.
J.Am.Chem.Soc., 136, 2014
7AJN
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BU of 7ajn by Molmil
Crystal Structure of the first bromodomain of BRD4 in complex with a BzD ligand
分子名称: 1,2-ETHANEDIOL, Bromodomain-containing protein 4, ~{N}-(1-adamantylmethyl)-2-[(7~{R},9~{S})-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.0^{2,6}]trideca-2(6),4,10,12-tetraen-9-yl]ethanamide
著者Picaud, S, Hassel-Hart, S, Tobias, K, Spencer, J, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Filippakopoulos, P.
登録日2020-09-29
公開日2020-12-02
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.48 Å)
主引用文献Crystal Structure of the first bromodomain of BRD4 in complex with a BzD ligand
To Be Published
3RUB
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BU of 3rub by Molmil
CRYSTAL STRUCTURE OF THE UNACTIVATED FORM OF RIBULOSE-1,5-BISPHOSPHATE CARBOXYLASE(SLASH)OXYGENASE FROM TOBACCO REFINED AT 2.0-ANGSTROMS RESOLUTION
分子名称: ASPARAGINE, RIBULOSE 1,5-BISPHOSPHATE CARBOXYLASE/OXYGENASE, FORM III, ...
著者Schreuder, H, Cascio, D, Curmi, P.M.G, Chapman, M.S, Suh, S.W, Eisenberg, D.S.
登録日1990-05-25
公開日1992-10-15
最終更新日2024-06-05
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystal structure of the unactivated form of ribulose-1,5-bisphosphate carboxylase/oxygenase from tobacco refined at 2.0-A resolution.
J.Biol.Chem., 267, 1992
1U35
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BU of 1u35 by Molmil
Crystal structure of the nucleosome core particle containing the histone domain of macroH2A
分子名称: H2A histone family, Hist1h4i protein, Histone H3.1, ...
著者Chakravarthy, S, Gundimella, S.K, Caron, C, Perche, P.Y, Pehrson, J.R, Khochbin, S, Luger, K.
登録日2004-07-20
公開日2005-09-27
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (3 Å)
主引用文献Structural characterization of the histone variant macroH2A.
Mol.Cell.Biol., 25, 2005
6TWN
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BU of 6twn by Molmil
Crystal structure of Talin1 R7R8 in complex with CDK1 (206-223)
分子名称: CHLORIDE ION, Cyclin-dependent kinase 1, GLYCEROL, ...
著者Zacharchenko, T, Muench, S.P, Goult, B.T.
登録日2020-01-13
公開日2021-05-12
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.28 Å)
主引用文献Talin mechanosensitivity is modulated by a direct interaction with cyclin-dependent kinase-1.
J.Biol.Chem., 297, 2021
6PHC
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BU of 6phc by Molmil
Pfs25 in complex with the human transmission blocking antibody 2544
分子名称: 25 kDa ookinete surface antigen, 2544 Antibody Fab, Heavy Chain, ...
著者McLeod, B.R, Julien, J.P.
登録日2019-06-25
公開日2019-10-02
最終更新日2024-04-03
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Potent antibody lineage against malaria transmission elicited by human vaccination with Pfs25.
Nat Commun, 10, 2019
3AAR
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BU of 3aar by Molmil
Crystal structure of Lp1NTPDase from Legionella pneumophila in complex with AMPPNP
分子名称: Ectonucleoside triphosphate diphosphohydrolase I, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER
著者Ge, H, Vivian, J.P, Beddoe, T, Rossjohn, J.
登録日2009-11-24
公開日2010-02-09
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Crystal Structure of a Legionella pneumophila Ecto -Triphosphate Diphosphohydrolase, A Structural and Functional Homolog of the Eukaryotic NTPDases
Structure, 18, 2010
2J89
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BU of 2j89 by Molmil
Functional and structural aspects of poplar cytosolic and plastidial type A methionine sulfoxide reductases
分子名称: BETA-MERCAPTOETHANOL, METHIONINE SULFOXIDE REDUCTASE A
著者Rouhier, N, Kauffmann, B, Tete-Favier, F, Palladino, P, Gans, P, Branlant, G, Jacquot, J.P, Boschi-Muller, S.
登録日2006-10-23
公開日2006-11-23
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Functional and Structural Aspects of Poplar Cytosolic and Plastidial Type a Methionine Sulfoxide Reductases
J.Biol.Chem., 282, 2007
6ETS
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BU of 6ets by Molmil
Crystal structure of KDM4D with tetrazolhydrazide compound 1
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Lysine-specific demethylase 4D, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-10-27
公開日2019-02-20
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.333 Å)
主引用文献Structure-Based Screening of Tetrazolylhydrazide Inhibitors versus KDM4 Histone Demethylases.
Chemmedchem, 14, 2019
7TBO
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BU of 7tbo by Molmil
LOV2-DARPIN fusion : D12
分子名称: D12 LOV2-DARPin fusion, GLYCEROL
著者Mittl, P.
登録日2021-12-22
公開日2023-07-05
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.32 Å)
主引用文献LOV2-DARPIN fusion : D12
To Be Published
5C5G
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BU of 5c5g by Molmil
Crystal Structure of Aspergillus clavatus Sph3
分子名称: 1,2-ETHANEDIOL, spherulin-4
著者Bamford, N.C, Little, D.J, Howell, P.L.
登録日2015-06-19
公開日2015-09-16
最終更新日2020-01-08
実験手法X-RAY DIFFRACTION (1.248 Å)
主引用文献Sph3 Is a Glycoside Hydrolase Required for the Biosynthesis of Galactosaminogalactan in Aspergillus fumigatus.
J.Biol.Chem., 290, 2015
6PNS
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BU of 6pns by Molmil
In situ structure of BTV RNA-dependent RNA polymerase in BTV virion
分子名称: Inner core structural protein VP3, RNA-directed RNA polymerase
著者He, Y, Shivakoti, S, Ding, K, Cui, Y, Roy, P, Zhou, Z.H.
登録日2019-07-03
公開日2019-08-07
最終更新日2024-03-20
実験手法ELECTRON MICROSCOPY (3.7 Å)
主引用文献In situ structures of RNA-dependent RNA polymerase inside bluetongue virus before and after uncoating.
Proc.Natl.Acad.Sci.USA, 116, 2019
6F2A
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BU of 6f2a by Molmil
Crystal structure of the complex Fe(II)/alpha-ketoglutarate dependent dioxygenase KDO1 with Fe(II)/Lysine
分子名称: ACETIC ACID, CHLORIDE ION, FE (II) ION, ...
著者Isabet, T, Stura, E.A, Legrand, P, Zaparucha, A, Bastard, K.
登録日2017-11-24
公開日2018-11-14
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural Studies based on two Lysine Dioxygenases with Distinct Regioselectivity Brings Insights Into Enzyme Specificity within the Clavaminate Synthase-Like Family.
Sci Rep, 8, 2018
4EPA
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BU of 4epa by Molmil
The crystal structure of the ferric yersiniabactin uptake receptor FyuA from Yersinia pestis
分子名称: LAURYL DIMETHYLAMINE-N-OXIDE, Pesticin receptor
著者Lukacik, P, Barnard, T.J, Buchanan, S.K.
登録日2012-04-17
公開日2012-06-20
最終更新日2012-07-04
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Structural engineering of a phage lysin that targets Gram-negative pathogens.
Proc.Natl.Acad.Sci.USA, 109, 2012
6PQL
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BU of 6pql by Molmil
SBP RafE in complex with raffinose
分子名称: ABC transporter sugar-binding protein, beta-D-fructofuranose-(2-1)-[alpha-D-galactopyranose-(1-6)]alpha-D-glucopyranose
著者Meier, E.P.W, Boraston, A.B.
登録日2019-07-09
公開日2019-10-02
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.65 Å)
主引用文献Molecular analysis of an enigmaticStreptococcus pneumoniaevirulence factor: The raffinose-family oligosaccharide utilization system.
J.Biol.Chem., 294, 2019
7AVQ
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BU of 7avq by Molmil
Crystal structure of haspin in complex with disubstituted imidazo[1,2- b]pyridazine inhibitor (compound 12)
分子名称: (2~{R})-2-[[3-(2~{H}-indazol-5-yl)imidazo[1,2-b]pyridazin-6-yl]amino]butan-1-ol, (4S)-2-METHYL-2,4-PENTANEDIOL, GLYCEROL, ...
著者Chaikuad, A, Bonnet, P, Routier, S, Knapp, S, Structural Genomics Consortium (SGC)
登録日2020-11-05
公開日2020-11-18
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Design of new disubstituted imidazo[1,2- b ]pyridazine derivatives as selective Haspin inhibitors. Synthesis, binding mode and anticancer biological evaluation.
J Enzyme Inhib Med Chem, 35, 2020
8IG7
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BU of 8ig7 by Molmil
Crystal structure of SARS-Cov-2 main protease G15S mutant in complex with GC376
分子名称: 3C-like proteinase nsp5, N~2~-[(benzyloxy)carbonyl]-N-{(2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]propan-2-yl}-L-leucinamide
著者Zeng, P, Zhang, J, Li, J.
登録日2023-02-20
公開日2024-03-06
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.69 Å)
主引用文献Structural Basis for Coronaviral Main Proteases Inhibition by the 3CLpro Inhibitor GC376.
J.Mol.Biol., 436, 2024
3NYN
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BU of 3nyn by Molmil
Crystal Structure of G Protein-Coupled Receptor Kinase 6 in Complex with Sangivamycin
分子名称: (R,R)-2,3-BUTANEDIOL, G protein-coupled receptor kinase 6, SANGIVAMYCIN, ...
著者Tesmer, J.J.G, Singh, P.
登録日2010-07-15
公開日2010-09-22
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.72 Å)
主引用文献Molecular basis for activation of G protein-coupled receptor kinases.
Embo J., 29, 2010
6P2N
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BU of 6p2n by Molmil
Crystal structure of Paenibacillus graminis GH74 (PgGH74)
分子名称: CHLORIDE ION, GLYCEROL, MAGNESIUM ION, ...
著者Stogios, P.J.
登録日2019-05-21
公開日2019-07-31
最終更新日2020-01-08
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Substrate specificity, regiospecificity, and processivity in glycoside hydrolase family 74.
J.Biol.Chem., 294, 2019
6F5R
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BU of 6f5r by Molmil
Crystal Structure of KDM4D with GF028 ligand
分子名称: 1,2-ETHANEDIOL, 2-(3-oxidanylpropylamino)pyridine-4-carboxylic acid, CHLORIDE ION, ...
著者Malecki, P.H, Link, A, Weiss, M.S, Heinemann, U.
登録日2017-12-02
公開日2018-12-12
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.607 Å)
主引用文献Crystal Structure of KDM4D with GF028 ligand
To be published
6P48
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Cryo-EM structure of calcium-bound TMEM16F in nanodisc with supplement of PIP2 in Cl1
分子名称: Anoctamin-6, CALCIUM ION
著者Feng, S, Dang, S, Han, T.W, Ye, W, Jin, P, Cheng, T, Li, J, Jan, Y.N, Jan, L.Y, Cheng, Y.
登録日2019-05-26
公開日2019-07-24
最終更新日2019-12-18
実験手法ELECTRON MICROSCOPY (3.2 Å)
主引用文献Cryo-EM Studies of TMEM16F Calcium-Activated Ion Channel Suggest Features Important for Lipid Scrambling.
Cell Rep, 28, 2019

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件を2024-08-14に公開中

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