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PDB: 51689 件

4MGB
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BU of 4mgb by Molmil
Crystal structure of hERa-LBD (Y537S) in complex with TCBPA
分子名称: 4,4'-propane-2,2-diylbis(2,6-dichlorophenol), Estrogen receptor, GLYCEROL, ...
著者Delfosse, V, Grimaldi, M, Bourguet, W.
登録日2013-08-28
公開日2014-09-03
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Structural and functional profiling of environmental ligands for estrogen receptors.
Environ.Health Perspect., 122, 2014
3M5V
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BU of 3m5v by Molmil
Crystal Structure of Dihydrodipicolinate Synthase from Campylobacter jejuni
分子名称: CHLORIDE ION, DI(HYDROXYETHYL)ETHER, Dihydrodipicolinate synthase, ...
著者Kim, Y, Zhou, M, Kwon, K, Anderson, W.F, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID)
登録日2010-03-13
公開日2010-04-28
最終更新日2012-02-29
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal Structure of Dihydrodipicolinate Synthase from Campylobacter jejuni
To be Published
6F6D
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BU of 6f6d by Molmil
The catalytic domain of KDM6B in complex with H3(17-33)K18IA21M peptide
分子名称: 2-OXOGLUTARIC ACID, FE (III) ION, Histone 3 peptide H3(17-33)K18IA21M, ...
著者Jones, S.E, Olsen, L, Gajhede, M.
登録日2017-12-05
公開日2018-10-17
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.81810677 Å)
主引用文献Structural Basis of Histone Demethylase KDM6B Histone 3 Lysine 27 Specificity.
Biochemistry, 57, 2018
7ZYR
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BU of 7zyr by Molmil
Compound 20 Bound to CK2alpha
分子名称: 5-bromanyl-6-chloranyl-3-(1~{H}-pyrrol-2-ylmethyl)-1~{H}-indole, ACETATE ION, ADENOSINE-5'-TRIPHOSPHATE, ...
著者Brear, P, Hyvonen, M.
登録日2022-05-25
公開日2022-10-12
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献A fragment-based approach leading to the discovery of inhibitors of CK2 alpha with a novel mechanism of action.
Rsc Med Chem, 13, 2022
1NH0
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BU of 1nh0 by Molmil
1.03 A structure of HIV-1 protease: inhibitor binding inside and outside the active site
分子名称: BETA-MERCAPTOETHANOL, PROTEASE RETROPEPSIN, SULFATE ION, ...
著者Brynda, J, Rezacova, P, Fabry, M, Horejsi, M, Hradilek, M, Soucek, M, Konvalinka, J, Sedlacek, J.
登録日2002-12-18
公開日2004-04-13
最終更新日2023-08-16
実験手法X-RAY DIFFRACTION (1.03 Å)
主引用文献A Phenylnorstatine Inhibitor Binding to HIV-1 Protease: Geometry, Protonation, and Subsite-Pocket Interactions Analyzed at Atomic Resolution
J.Med.Chem., 47, 2004
1KER
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BU of 1ker by Molmil
The crystal structure of dTDP-D-glucose 4,6-dehydratase (RmlB) from Streptococcus suis with dTDP-D-glucose bound
分子名称: 2'DEOXY-THYMIDINE-5'-DIPHOSPHO-ALPHA-D-GLUCOSE, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, SULFATE ION, ...
著者Allard, S.T.M, Beis, K, Giraud, M.-F, Hegeman, A.D, Gross, J.W, Whitfield, C, Graninger, M, Messner, P, Allen, A.G, Naismith, J.H.
登録日2001-11-17
公開日2002-01-25
最終更新日2023-08-16
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Toward a structural understanding of the dehydratase mechanism.
Structure, 10, 2002
6JGC
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BU of 6jgc by Molmil
Crystal structure of barley exohydrolaseI W286Y mutant in complex with glucose.
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, ACETATE ION, BETA-D-GLUCAN GLUCOHYDROLASE ISOENZYME EXO1, ...
著者Luang, S, Streltsov, V.A, Hrmova, M.
登録日2019-02-13
公開日2020-08-19
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.36 Å)
主引用文献The evolutionary advantage of an aromatic clamp in plant family 3 glycoside exo-hydrolases.
Nat Commun, 13, 2022
2MQF
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BU of 2mqf by Molmil
NMR structure of spider toxin-TRTX-Hhn2b
分子名称: Mu-theraphotoxin-Hhn2b
著者Klint, J.K, Chin, Y.K.Y, Mobli, M.
登録日2014-06-19
公開日2015-07-15
最終更新日2023-06-14
実験手法SOLUTION NMR
主引用文献Rational Engineering Defines a Molecular Switch That Is Essential for Activity of Spider-Venom Peptides against the Analgesics Target NaV1.7
Mol.Pharmacol., 88, 2015
1KFM
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BU of 1kfm by Molmil
Core side-chain packing and backbone conformation in Lpp-56 coiled-coil mutants
分子名称: MAJOR OUTER MEMBRANE LIPOPROTEIN
著者Liu, J, Cao, W, Lu, M.
登録日2001-11-21
公開日2002-06-28
最終更新日2023-08-16
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Core side-chain packing and backbone conformation in Lpp-56 coiled-coil mutants.
J.Mol.Biol., 318, 2002
4MHG
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BU of 4mhg by Molmil
Crystal structure of ETV6 bound to a specific DNA sequence
分子名称: Complementary Specific 14 bp DNA, Specific 14 bp DNA, Transcription factor ETV6
著者Chan, A.C, De, S, Coyne III, H.J, Okon, M, Murphy, M.E, Graves, B.J, McIntosh, L.P.
登録日2013-08-29
公開日2014-01-08
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.199 Å)
主引用文献Steric Mechanism of Auto-Inhibitory Regulation of Specific and Non-Specific DNA Binding by the ETS Transcriptional Repressor ETV6.
J.Mol.Biol., 426, 2014
6JGS
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BU of 6jgs by Molmil
Crystal structure of barley exohydrolaseI W434Y mutant in complex with 4I,4III,4V-S-trithiocellohexaose.
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, ACETATE ION, BETA-D-GLUCAN GLUCOHYDROLASE ISOENZYME EXO1, ...
著者Luang, S, Streltsov, V.A, Hrmova, M.
登録日2019-02-14
公開日2020-08-19
最終更新日2023-11-29
実験手法X-RAY DIFFRACTION (2.03 Å)
主引用文献The evolutionary advantage of an aromatic clamp in plant family 3 glycoside exo-hydrolases.
Nat Commun, 13, 2022
1KFW
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BU of 1kfw by Molmil
Structure of catalytic domain of psychrophilic chitinase B from Arthrobacter TAD20
分子名称: GLYCEROL, chitinase B
著者Ayati, M, Mandelman, D, Aghajari, N, Haser, R.
登録日2001-11-23
公開日2002-11-23
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.74 Å)
主引用文献Structure of catalytical domain of psychrophilic chitinase from Arthobacter, with and without allosamidine
To be Published
8A8U
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BU of 8a8u by Molmil
Mycobacterium tuberculosis ClpC1 hexamer structure
分子名称: ADENOSINE-5'-DIPHOSPHATE, ATP-dependent Clp protease ATP-binding subunit ClpC1, Bound polypeptide
著者Felix, J, Fraga, H, Gragera, M, Bueno, T, Weinhaeupl, K.
登録日2022-06-24
公開日2022-10-26
最終更新日2024-07-24
実験手法ELECTRON MICROSCOPY (3.62 Å)
主引用文献Structure of the drug target ClpC1 unfoldase in action provides insights on antibiotic mechanism of action.
J.Biol.Chem., 298, 2022
2BWJ
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BU of 2bwj by Molmil
Structure of adenylate kinase 5
分子名称: ADENOSINE MONOPHOSPHATE, ADENYLATE KINASE 5, CHLORIDE ION, ...
著者Bunkoczi, G, Filippakopoulos, P, Fedorov, O, Jansson, A, Longman, E, Ugochukwu, E, Knapp, S, von Delft, F, Arrowsmith, C, Edwards, A, Sundstrom, M, Weigelt, J.
登録日2005-07-14
公開日2005-07-21
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structure of Adenylate Kinase 5
To be Published
4YOP
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BU of 4yop by Molmil
CRYSTAL STRUCTURE OF HEN EGG-WHITE LYSOZYME
分子名称: CHLORIDE ION, Lysozyme C, SODIUM ION
著者Sugahara, M, Nakane, T, Suzuki, M, Nango, E.
登録日2015-03-12
公開日2015-12-23
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (2.1 Å)
主引用文献Native sulfur/chlorine SAD phasing for serial femtosecond crystallography
Acta Crystallogr.,Sect.D, 71, 2015
1KGL
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BU of 1kgl by Molmil
Solution structure of cellular retinol binding protein type-I in complex with all-trans-retinol
分子名称: CELLULAR RETINOL-BINDING PROTEIN TYPE I, RETINOL
著者Franzoni, L, Luecke, C, Perez, C, Cavazzini, D, Rademacher, M, Ludwig, C, Spisni, A, Rossi, G.L, Rueterjans, H.
登録日2001-11-27
公開日2002-06-19
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Structure and Backbone Dynamics of Apo- and Holo-cellular Retinol-binding Protein in Solution.
J.Biol.Chem., 277, 2002
2MY8
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BU of 2my8 by Molmil
NMR Structure of RRM-3 domain of ETR-3
分子名称: CUGBP Elav-like family member 2
著者Kashyap, M, Bhatt, H.P, Ganguly, A.K, Bhavesh, N.S.
登録日2015-01-21
公開日2015-02-04
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Structure of an Unfolding Intermediate of an RRM Domain of ETR-3 Reveals Its Native-like Fold.
Biophys.J., 118, 2020
5ABS
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BU of 5abs by Molmil
CRYSTAL STRUCTURE OF THE C-TERMINAL COILED-COIL DOMAIN OF CIN85 IN SPACE GROUP P321
分子名称: SH3 DOMAIN-CONTAINING KINASE-BINDING PROTEIN 1, ZINC ION
著者Wong, L, Habeck, M, Griesinger, C, Becker, S.
登録日2015-08-07
公開日2016-07-13
最終更新日2019-02-06
実験手法X-RAY DIFFRACTION (1.74 Å)
主引用文献The Adaptor Protein Cin85 Assembles Intracellular Signaling Clusters for B Cell Activation.
Sci.Signal., 9, 2016
8A8V
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BU of 8a8v by Molmil
Mycobacterium tuberculosis ClpC1 hexamer structure bound to the natural product antibiotic Cyclomarin
分子名称: ADENOSINE-5'-DIPHOSPHATE, ATP-dependent Clp protease ATP-binding subunit ClpC1, Bound polypeptide
著者Felix, J, Fraga, H, Gragera, M, Bueno, T, Weinhaeupl, K.
登録日2022-06-24
公開日2022-10-26
最終更新日2024-07-24
実験手法ELECTRON MICROSCOPY (3.34 Å)
主引用文献Structure of the drug target ClpC1 unfoldase in action provides insights on antibiotic mechanism of action.
J.Biol.Chem., 298, 2022
8A8W
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BU of 8a8w by Molmil
Mycobacterium tuberculosis ClpC1 hexamer structure bound to the natural product antibiotic Ecumycin (class 1)
分子名称: ADENOSINE-5'-DIPHOSPHATE, ATP-dependent Clp protease ATP-binding subunit ClpC1, Bound polypeptide
著者Felix, J, Fraga, H, Gragera, M, Bueno, T, Weinhaeupl, K.
登録日2022-06-24
公開日2022-10-26
最終更新日2024-07-24
実験手法ELECTRON MICROSCOPY (4.29 Å)
主引用文献Structure of the drug target ClpC1 unfoldase in action provides insights on antibiotic mechanism of action.
J.Biol.Chem., 298, 2022
6F3C
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BU of 6f3c by Molmil
The cytotoxic [Pt(H2bapbpy)] platinum complex interacting with the CGTACG hexamer
分子名称: DNA (5'-D(*GP*TP*AP*CP*G)-3'), MAGNESIUM ION, [Pt(H2bapbpy)] platinum
著者Ferraroni, M, Bazzicalupi, C, Gratteri, P, Papi, F.
登録日2017-11-28
公開日2019-05-29
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Induction of a Four-Way Junction Structure in the DNA Palindromic Hexanucleotide 5'-d(CGTACG)-3' by a Mononuclear Platinum Complex.
Angew.Chem.Int.Ed.Engl., 58, 2019
6JJW
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BU of 6jjw by Molmil
Crystal Structure of KIBRA and PTPN14 complex
分子名称: CHLORIDE ION, FORMIC ACID, GLYCEROL, ...
著者Lin, Z, Yang, Z, Ji, Z, Zhang, M.
登録日2019-02-27
公開日2019-09-25
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Decoding WW domain tandem-mediated target recognitions in tissue growth and cell polarity.
Elife, 8, 2019
6FD4
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BU of 6fd4 by Molmil
Crystal Structure of Human APRT-Tyr105Phe variant in complex with Adenine, PRPP and Mg2+, 14 hours post crystallization
分子名称: 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose, Adenine phosphoribosyltransferase, MAGNESIUM ION
著者Nioche, P, Huyet, J, Ozeir, M.
登録日2017-12-21
公開日2018-08-15
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Structural Insights into the Forward and Reverse Enzymatic Reactions in Human Adenine Phosphoribosyltransferase.
Cell Chem Biol, 25, 2018
4LUE
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BU of 4lue by Molmil
Crystal Structure of HCK in complex with 7-[trans-4-(4-methylpiperazin-1-yl)cyclohexyl]-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine (resulting from displacement of SKF86002)
分子名称: 7-[trans-4-(4-methylpiperazin-1-yl)cyclohexyl]-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine, CALCIUM ION, CHLORIDE ION, ...
著者Parker, L.J, Tanaka, A, Handa, N, Honda, K, Tomabechi, Y, Shirouzu, M, Yokoyama, S.
登録日2013-07-25
公開日2014-02-12
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (3.04 Å)
主引用文献Kinase crystal identification and ATP-competitive inhibitor screening using the fluorescent ligand SKF86002.
Acta Crystallogr.,Sect.D, 70, 2014
4M9F
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BU of 4m9f by Molmil
Dengue virus NS2B-NS3 protease A125C variant at pH 8.5
分子名称: NS2B-NS3 protease
著者Yildiz, M, Ghosh, S, Bell, J.A, Sherman, W, Hardy, J.A.
登録日2013-08-14
公開日2013-11-27
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献Allosteric Inhibition of the NS2B-NS3 Protease from Dengue Virus.
Acs Chem.Biol., 8, 2013

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件を2024-09-04に公開中

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