5AQQ
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![BU of 5aqq by Molmil](/molmil-images/mine/5aqq) | Fragment-based screening of HSP70 sheds light on the functional role of ATP-binding site residues | Descriptor: | 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 7-methylquinazolin-4-amine, BAG FAMILY MOLECULAR CHAPERONE REGULATOR 1, ... | Authors: | Jones, A.M, Westwood, I.M, Osborne, J.D, Matthews, T.P, Cheeseman, M.D, Rowlands, M.G, Jeganathan, F, Burke, R, Lee, D, Kadi, N, Liu, M, Richards, M, McAndrew, C, Yahya, N, Dobson, S.E, Jones, K, Workman, P, Collins, I, van Montfort, R.L.M. | Deposit date: | 2015-09-22 | Release date: | 2016-10-05 | Last modified: | 2024-01-10 | Method: | X-RAY DIFFRACTION (2.72 Å) | Cite: | A fragment-based approach applied to a highly flexible target: Insights and challenges towards the inhibition of HSP70 isoforms. Sci Rep, 6, 2016
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5AQR
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![BU of 5aqr by Molmil](/molmil-images/mine/5aqr) | Fragment-based screening of HSP70 sheds light on the functional role of ATP-binding site residues | Descriptor: | 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 6-methoxyquinazolin-4-amine, BAG FAMILY MOLECULAR CHAPERONE REGULATOR 1, ... | Authors: | Jones, A.M, Westwood, I.M, Osborne, J.D, Matthews, T.P, Cheeseman, M.D, Rowlands, M.G, Jeganathan, F, Burke, R, Lee, D, Kadi, N, Liu, M, Richards, M, McAndrew, C, Yahya, N, Dobson, S.E, Jones, K, Workman, P, Collins, I, van Montfort, R.L.M. | Deposit date: | 2015-09-22 | Release date: | 2016-10-05 | Last modified: | 2024-01-10 | Method: | X-RAY DIFFRACTION (1.91 Å) | Cite: | A fragment-based approach applied to a highly flexible target: Insights and challenges towards the inhibition of HSP70 isoforms. Sci Rep, 6, 2016
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2JQR
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![BU of 2jqr by Molmil](/molmil-images/mine/2jqr) | Solution model of crosslinked complex of cytochrome c and adrenodoxin | Descriptor: | Adrenodoxin, mitochondrial, Cytochrome c iso-1, ... | Authors: | Xu, X, Reinle, W, Hannemann, F, Konarev, P.V, Svergun, D.I, Bernhardt, R, Ubbink, M. | Deposit date: | 2007-06-07 | Release date: | 2008-04-22 | Last modified: | 2023-12-20 | Method: | SOLUTION NMR | Cite: | Dynamics in a pure encounter complex of two proteins studied by solution scattering and paramagnetic NMR spectroscopy J.Am.Chem.Soc., 130, 2008
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2JNZ
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2JNP
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![BU of 2jnp by Molmil](/molmil-images/mine/2jnp) | Solution structure of matrix metalloproteinase 3 (MMP-3) in the presence of N-isobutyl-N-[4-methoxyphenylsulfonyl]glycyl hydroxamic acid (NNGH) | Descriptor: | CALCIUM ION, Matrix metalloproteinase-3, N-ISOBUTYL-N-[4-METHOXYPHENYLSULFONYL]GLYCYL HYDROXAMIC ACID, ... | Authors: | Alcaraz, L.A, Banci, L, Bertini, I, Cantini, F, Donaire, A, Gonnelli, L. | Deposit date: | 2007-01-30 | Release date: | 2007-12-11 | Last modified: | 2024-05-08 | Method: | SOLUTION NMR | Cite: | Matrix metalloproteinase-inhibitor interaction: the solution structure of the catalytic domain of human matrix metalloproteinase-3 with different inhibitors J.Biol.Inorg.Chem., 12, 2007
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2JP6
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![BU of 2jp6 by Molmil](/molmil-images/mine/2jp6) | Structural and functional characterization of the recombinant form of the Kv1.3 channel blocker Tc32 | Descriptor: | Potassium channel toxin alpha-KTx 18.1 | Authors: | Stehling, E.G, Sforca, M.L, Zanchin, N.I, Pignatelli, A, Belluzzi, O, Spisni, A, Pertinhez, T.A. | Deposit date: | 2007-04-26 | Release date: | 2008-04-29 | Last modified: | 2023-12-20 | Method: | SOLUTION NMR | Cite: | Structural and functional characterization of the recombinant form of the
Kv1.3 channel blocker Tc32 To be Published
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2JPP
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![BU of 2jpp by Molmil](/molmil-images/mine/2jpp) | Structural basis of RsmA/CsrA RNA recognition: Structure of RsmE bound to the Shine-Dalgarno sequence of hcnA mRNA | Descriptor: | RNA (5'-R(*GP*GP*GP*CP*UP*UP*CP*AP*CP*GP*GP*AP*UP*GP*AP*AP*GP*CP*CP*C)-3'), Translational repressor | Authors: | Schubert, M, Lapouge, K, Duss, O, Oberstrass, F.C, Jelesarov, I, Haas, D, Allain, F.H.-T. | Deposit date: | 2007-05-21 | Release date: | 2007-08-21 | Last modified: | 2023-12-20 | Method: | SOLUTION NMR | Cite: | Molecular basis of messenger RNA recognition by the specific bacterial repressing clamp RsmA/CsrA Nat.Struct.Mol.Biol., 14, 2007
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2JON
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![BU of 2jon by Molmil](/molmil-images/mine/2jon) | Solution structure of the C-terminal domain Ole e 9 | Descriptor: | Beta-1,3-glucanase | Authors: | Trevino, M.A, Palomares, O, Castrillo, I, Villalba, M, Rodriguez, R, Rico, M, Santoro, J, Bruix, M. | Deposit date: | 2007-03-14 | Release date: | 2008-01-29 | Last modified: | 2023-12-20 | Method: | SOLUTION NMR | Cite: | Solution structure of the C-terminal domain of Ole e 9, a major allergen of olive pollen Protein Sci., 17, 2008
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4V1I
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![BU of 4v1i by Molmil](/molmil-images/mine/4v1i) | Structure of a novel carbohydrate binding module from glycoside hydrolase family 5 glucanase from Ruminococcus flavefaciens FD-1 at medium resolution | Descriptor: | CARBOHYDRATE BINDING MODULE | Authors: | Venditto, I, Centeno, M.S.J, Ferreira, L.M.A, Fontes, C.M.G.A, Najmudin, S. | Deposit date: | 2014-09-26 | Release date: | 2016-01-20 | Last modified: | 2024-01-10 | Method: | X-RAY DIFFRACTION (2.59 Å) | Cite: | Complexity of the Ruminococcus Flavefaciens Cellulosome Reflects an Expansion in Glycan Recognition. Proc.Natl.Acad.Sci.USA, 113, 2016
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2JHC
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![BU of 2jhc by Molmil](/molmil-images/mine/2jhc) | The structure of bluetongue virus VP4 reveals a multifunctional RNA- capping production-line | Descriptor: | GUANINE, VP4 CORE PROTEIN | Authors: | Sutton, G, Grimes, J.M, Stuart, D.I, Roy, P. | Deposit date: | 2007-02-21 | Release date: | 2007-04-10 | Last modified: | 2024-05-08 | Method: | X-RAY DIFFRACTION (3 Å) | Cite: | Bluetongue Virus Vp4 is an RNA-Capping Assembly Line. Nat.Struct.Mol.Biol., 14, 2007
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2JKG
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![BU of 2jkg by Molmil](/molmil-images/mine/2jkg) | Plasmodium falciparum profilin | Descriptor: | MAGNESIUM ION, OCTAPROLINE PEPTIDE, PROFILIN | Authors: | Kursula, I, Kursula, P, Ganter, M, Panjikar, S, Matuschewski, K, Schueler, H. | Deposit date: | 2008-08-28 | Release date: | 2008-09-23 | Last modified: | 2024-05-08 | Method: | X-RAY DIFFRACTION (1.89 Å) | Cite: | Structural Basis for Parasite-Specific Functions of the Divergent Profilin of Plasmodium Falciparum. Structure, 16, 2008
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6F0D
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![BU of 6f0d by Molmil](/molmil-images/mine/6f0d) | Crystal structure of a llama VHH antibody BCD090-M2 against human ErbB3 in space group P1 with cadmium ions | Descriptor: | CADMIUM ION, VHH antibody BCD090-M2 | Authors: | Eliseev, I.E, Yudenko, A.N, Vysochinskaya, V.V, Svirina, A.A, Evstratyeva, A.V, Drozhzhachih, M.S, Krendeleva, E.A, Vladimirova, A.K, Nemankin, T.A, Ekimova, V.M, Ulitin, A.B, Lomovskaya, M.I, Yakovlev, P.A, Moiseenko, F.V, Chakchir, O.B. | Deposit date: | 2017-11-19 | Release date: | 2017-11-29 | Last modified: | 2024-01-17 | Method: | X-RAY DIFFRACTION (1.90000749 Å) | Cite: | Crystal structures of a llama VHH antibody BCD090-M2 targeting human ErbB3 receptor. F1000Res, 7, 2018
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2JKF
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![BU of 2jkf by Molmil](/molmil-images/mine/2jkf) | Plasmodium falciparum profilin | Descriptor: | PROFILIN | Authors: | Kursula, I, Kursula, P, Ganter, M, Panjikar, S, Matuschewski, K, Schueler, H. | Deposit date: | 2008-08-28 | Release date: | 2008-09-23 | Last modified: | 2024-05-08 | Method: | X-RAY DIFFRACTION (2.31 Å) | Cite: | Structural Basis for Parasite-Specific Functions of the Divergent Profilin of Plasmodium Falciparum Structure, 16, 2008
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2JL9
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![BU of 2jl9 by Molmil](/molmil-images/mine/2jl9) | Structural explanation for the role of Mn in the activity of phi6 RNA- dependent RNA polymerase | Descriptor: | RNA-DIRECTED RNA POLYMERASE | Authors: | Poranen, M.M, Salgado, P.S, Koivunen, M.R.L, Wright, S, Bamford, D.H, Stuart, D.I, Grimes, J.M. | Deposit date: | 2008-09-05 | Release date: | 2008-11-04 | Last modified: | 2024-05-08 | Method: | X-RAY DIFFRACTION (3.2 Å) | Cite: | Structural Explanation for the Role of Mn2+ in the Activity of {Phi}6 RNA-Dependent RNA Polymerase. Nucleic Acids Res., 36, 2008
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2JHA
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![BU of 2jha by Molmil](/molmil-images/mine/2jha) | The structure of bluetongue virus VP4 reveals a multifunctional RNA- capping production-line | Descriptor: | DIGUANOSINE-5'-TRIPHOSPHATE, GUANINE, VP4 CORE PROTEIN | Authors: | Sutton, G, Grimes, J.M, Stuart, D.I, Roy, P. | Deposit date: | 2007-02-21 | Release date: | 2007-04-10 | Last modified: | 2024-05-08 | Method: | X-RAY DIFFRACTION (3.4 Å) | Cite: | Bluetongue Virus Vp4 is an RNA-Capping Assembly Line. Nat.Struct.Mol.Biol., 14, 2007
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7SBU
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2K7J
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![BU of 2k7j by Molmil](/molmil-images/mine/2k7j) | Human Acylphosphatase(AcPh) surface charge-optimized | Descriptor: | Acylphosphatase-1 | Authors: | Gribenko, A.V, Patel, M.M, Liu, J, McCallum, S.A, Wang, C, Makhatadze, G.I. | Deposit date: | 2008-08-12 | Release date: | 2009-02-17 | Last modified: | 2024-05-22 | Method: | SOLUTION NMR | Cite: | Rational stabilization of enzymes by computational redesign of surface charge-charge interactions Proc.Natl.Acad.Sci.USA, 106, 2009
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2KAX
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![BU of 2kax by Molmil](/molmil-images/mine/2kax) | Solution structure and dynamics of S100A5 in the apo and Ca2+ -bound states | Descriptor: | Protein S100-A5 | Authors: | Bertini, I, Das Gupta, S, Hu, X, Karavelas, T, Luchinat, C, Parigi, G, Yuan, J, Structural Proteomics in Europe (SPINE), Structural Proteomics in Europe 2 (SPINE-2) | Deposit date: | 2008-11-17 | Release date: | 2009-06-30 | Last modified: | 2024-05-01 | Method: | SOLUTION NMR | Cite: | Solution structure and dynamics of S100A5 in the apo and Ca2+-bound states J.Biol.Inorg.Chem., 14, 2009
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2K8Z
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![BU of 2k8z by Molmil](/molmil-images/mine/2k8z) | Dimeric solution structure of the DNA loop d(TCGTTGCT) | Descriptor: | 5'-D(*TP*CP*GP*TP*TP*GP*CP*T)-3' | Authors: | Viladoms, J, Escaja, N, Frieden, M, Gomez-Pinto, I, Pedroso, E, Gonzalez, C. | Deposit date: | 2008-09-29 | Release date: | 2009-04-28 | Last modified: | 2024-05-01 | Method: | SOLUTION NMR | Cite: | Self-association of short DNA loops through minor groove C:G:G:C tetrads. Nucleic Acids Res., 37, 2009
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5IV9
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![BU of 5iv9 by Molmil](/molmil-images/mine/5iv9) | The LPS Transporter LptDE from Klebsiella pneumoniae, full-length | Descriptor: | (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE, LPS-assembly lipoprotein LptE, LPS-assembly protein LptD | Authors: | Botos, I, McCarthy, J.G, Buchanan, S.K. | Deposit date: | 2016-03-20 | Release date: | 2016-05-18 | Last modified: | 2016-06-15 | Method: | X-RAY DIFFRACTION (4.369 Å) | Cite: | Structural and Functional Characterization of the LPS Transporter LptDE from Gram-Negative Pathogens. Structure, 24, 2016
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2KH2
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![BU of 2kh2 by Molmil](/molmil-images/mine/2kh2) | Solution structure of a scFv-IL-1B complex | Descriptor: | Interleukin-1 beta, scFv | Authors: | Wilkinson, I.C, Hall, C.J, Veverka, V, Muskett, F.W, Stephens, P.E, Taylor, R.J, Henry, A.J, Carr, M.D. | Deposit date: | 2009-03-23 | Release date: | 2009-09-08 | Last modified: | 2022-03-16 | Method: | SOLUTION NMR | Cite: | High resolution NMR-based model for the structure of a scFv-IL-1beta complex: potential for NMR as a key tool in therapeutic antibody design and development. J.Biol.Chem., 284, 2009
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2KE6
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2KHU
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![BU of 2khu by Molmil](/molmil-images/mine/2khu) | Solution Structure of the Ubiquitin-Binding Motif of Human Polymerase Iota | Descriptor: | Immunoglobulin G-binding protein G, DNA polymerase iota | Authors: | Bomar, M.G, D'Souza, S, Bienko, M, Dikic, I, Walker, G. | Deposit date: | 2009-04-11 | Release date: | 2010-02-23 | Last modified: | 2024-05-22 | Method: | SOLUTION NMR | Cite: | Unconventional Ubiquitin Recognition by the Ubiquitin-Binding Motif within the Y Family DNA Polymerases iota and Rev1. Mol.Cell, 37, 2010
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2KJB
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2K6L
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![BU of 2k6l by Molmil](/molmil-images/mine/2k6l) | The solution structure of XACb0070 from Xanthonomas axonopodis pv citri reveals this new protein is a member of the RHH family of transcriptional repressors | Descriptor: | Putative uncharacterized protein | Authors: | Gallo, M, Cicero, D.O, Amata, I, Eliseo, T, Paci, M, Spisni, A, Ferrari, E, Pertinhez, T.A, Farah, C.S. | Deposit date: | 2008-07-11 | Release date: | 2009-06-16 | Last modified: | 2024-05-29 | Method: | SOLUTION NMR | Cite: | The solution structure reveals that XACb0070 from the plant pathogen Xanthomonas citri belongs to the RHH superfamily of bacterial DNA-binding proteins To be Published
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