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51.

6801
Accesses

Research article   Open Access

Functional evolution of two subtly different (similar) folds

Vishal Agrawal, Radha KV Kishan BMC Structural Biology 2001, 1:5 (21 December 2001)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central

52.

6642
Accesses

Research article   Open Access Highly Accessed

Docking of molecules identified in bioactive medicinal plants extracts into the p50 NF-kappaB transcription factor: correlation with inhibition of NF-kappaB/DNA interactions and inhibitory effects on IL-8 gene expression

Laura Piccagli, Enrica Fabbri, Monica Borgatti, Valentino Bezzerri, Irene Mancini, Elena Nicolis, Maria C Dechecchi, Ilaria Lampronti, Giulio Cabrini, Roberto Gambari BMC Structural Biology 2008, 8:38 (3 September 2008)

Abstract | Full text | PDF | PubMed |  Editor’s summary

Predicting the docking of 27 molecules from medicinal plants to NFkb-p50 helped identify a new lead compound shown experimentally to inhibit NFkb-p50 and modulate the expression of the NFkb-regulated gene IL8.

53.

6565
Accesses

Research article   Open Access

Structural analysis of hemicatenated DNA loops

Claire Gaillard, Luda S Shlyakhtenko, Yuri L Lyubchenko, François Strauss BMC Structural Biology 2002, 2:7 (26 November 2002)

Abstract | Full text | PDF | PubMed

54.

6507
Accesses

Research article   Open Access Highly Accessed

Spectrum of disease-causing mutations in protein secondary structures

Sofia Khan, Mauno Vihinen BMC Structural Biology 2007, 7:56 (29 August 2007)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central

55.

6390
Accesses

Research article   Open Access Highly Accessed

Structural characterization of CA1462, the Candida albicans thiamine pyrophosphokinase

Sébastien Santini, Vincent Monchois, Nicolas Mouz, Cécile Sigoillot, Tristan Rousselle, Jean-Michel Claverie, Chantal Abergel BMC Structural Biology 2008, 8:33 (24 July 2008)

Abstract | Full text | PDF | PubMed

56.

6321
Accesses

Research article   Open Access Highly Accessed

Structural organization and interactions of transmembrane domains in tetraspanin proteins

Oleg V Kovalenko, Douglas G Metcalf, William F DeGrado, Martin E Hemler BMC Structural Biology 2005, 5:11 (28 June 2005)

Abstract | Full text | PDF | PubMed

57.

6227
Accesses

Research article   Open Access Highly Accessed

Mechanisms for stabilisation and the maintenance of solubility in proteins from thermophiles

Richard B Greaves, Jim Warwicker BMC Structural Biology 2007, 7:18 (29 March 2007)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central |  Editor’s summary

Hyperthermophilic proteins have more charged groups and less burial of aromatic side chains than related proteins in organisms that grow at lower temperatures, which may prevent aggregation and stabilise the proteins.

58.

6216
Accesses

Research article   Open Access Highly Accessed

Sequence and structural features of carbohydrate binding in proteins and assessment of predictability using a neural network

Adeel Malik, Shandar Ahmad BMC Structural Biology 2007, 7:1 (3 January 2007)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central

59.

6179
Accesses

Research article   Open Access

Crystal structure of LIR-2 (ILT4) at 1.8 Å: differences from LIR-1 (ILT2) in regions implicated in the binding of the Human Cytomegalovirus class I MHC homolog UL18

Benjamin E Willcox, Leonard M Thomas, Tara L Chapman, Astrid P Heikema, Anthony P West, Pamela J Bjorkman BMC Structural Biology 2002, 2:6 (11 October 2002)

Abstract | Full text | PDF | PubMed |  Editor’s summary

The crystal structure of the cell surface receptor LIR-2 reveals differences that may explain why it binds only weakly to a human cytomegalovirus class I MHC homolog, whereas the highly-related LIR-1 binds strongly.

60.

6140
Accesses

Research article   Open Access Highly Accessed

Energetics of the protein-DNA-water interaction

Francesca Spyrakis, Pietro Cozzini, Chiara Bertoli, Anna Marabotti, Glen E Kellogg, Andrea Mozzarelli BMC Structural Biology 2007, 7:4 (10 January 2007)

Abstract | Full text | PDF | PubMed

61.

6108
Accesses

Research article   Open Access

A homology model of restriction endonuclease SfiI in complex with DNA

Agnieszka A Chmiel, Janusz M Bujnicki, Krzysztof J Skowronek BMC Structural Biology 2005, 5:2 (24 January 2005)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central |  Editor’s summary

The threading approach for fold recognition indicates that the Type IIF restriction enzyme SfiI is more related to BglI, a Type IIP enzyme, than to other Type IIF enzymes, suggesting that tetramer formation evolved at least twice in the PD-DxK superfamily.

62.

6067
Accesses

Research article   Open Access Highly Accessed

Donor substrate recognition in the raffinose-bound E342A mutant of fructosyltransferase Bacillus subtilis levansucrase

Guoyu Meng, Klaus Fütterer BMC Structural Biology 2008, 8:16 (17 March 2008)

Abstract | Full text | PDF | PubMed

63.

6019
Accesses

Software   Open Access Highly Accessed

PTools: an opensource molecular docking library

Adrien Saladin, Sébastien Fiorucci, Pierre Poulain, Chantal Prévost, Martin Zacharias BMC Structural Biology 2009, 9:27 (1 May 2009)

Abstract | Full text | PDF | PubMed

64.

5988
Accesses

Research article   Open Access Highly Accessed

A silent H-bond can be mutationally activated for high-affinity interaction of BMP-2 and activin type IIB receptor

Dionys Weber, Alexander Kotzsch, Joachim Nickel, Stefan Harth, Axel Seher, Uwe Mueller, Walter Sebald, Thomas D Mueller BMC Structural Biology 2007, 7:6 (12 February 2007)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central |  Editor’s summary

The binding specificity of BMP-2 for its receptors is dramatically changed by mutations in only one or two residues, in particular mutations activating a conserved H-bond that controls a switch from low- to high-affinity binding.

65.

5923
Accesses

Research article   Open Access Highly Accessed

Comparative Analysis of Protein Structure Alignments

Gabriele Mayr, Francisco S Domingues, Peter Lackner BMC Structural Biology 2007, 7:50 (26 July 2007)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central |  Editor’s summary

A rigorous framework for objectively comparing 3D protein structure alignment programs shows that although alignments produced by different methods tend to agree, there is still room for improvement on more challenging protein pairs.

66.

5896
Accesses

Research article   Open Access

Cα-H···O=C hydrogen bonds contribute to the specificity of RGD cell-adhesion interactions

Jordi Bella, Martin J Humphries BMC Structural Biology 2005, 5:4 (14 February 2005)

Abstract | Full text | PDF | PubMed

67.

5885
Accesses

Research article   Open Access

Types of inter-atomic interactions at the MHC-peptide interface: Identifying commonality from accumulated data

Png Adrian, Ganapathy Rajaseger, Venkatarajan Mathura, Meena Sakharkar, Pandjassarame Kangueane BMC Structural Biology 2002, 2:2 (13 May 2002)

Abstract | Full text | PDF | PubMed

68.

5736
Accesses

Research article   Open Access Highly Accessed

On the origin of the histone fold

Vikram Alva, Moritz Ammelburg, Johannes Söding, Andrei N Lupas BMC Structural Biology 2007, 7:17 (28 March 2007)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central |  Editor’s summary

A helix-strand-helix motif that probably gave rise to a domain in both Hsp100 and AAA+ proteins was further adapted by 3D domain-swapping to result in the unique histone fold.

69.

5664
Accesses

Research article   Open Access Highly Accessed

An in silico study of the molecular basis of B-RAF activation and conformational stability

Filip F Fratev, Svava Jónsdóttir BMC Structural Biology 2009, 9:47 (22 July 2009)

Abstract | Full text | PDF | PubMed

70.

5631
Accesses

Research article   Open Access Highly Accessed

The binding site for neohesperidin dihydrochalcone at the human sweet taste receptor

Marcel Winnig, Bernd Bufe, Nicole A Kratochwil, Jay P Slack, Wolfgang Meyerhof BMC Structural Biology 2007, 7:66 (12 October 2007)

Abstract | Full text | PDF | PubMed |  Editor’s summary

The artificial sweetener neohesperidin dihydrochalcone activates human, but not rat, taste receptors and using chimeric rat-human receptors its binding site was found to overlap that of the sweetener cyclamate and the sweet-taste inhibitor lactisole.

71.

5502
Accesses

Research article   Open Access Highly Accessed

Structure of a conserved hypothetical protein SA1388 from S. aureus reveals a capped hexameric toroid with two PII domain lids and a dinuclear metal center

Kumar Saikatendu, Xuejun Zhang, Lisa Kinch, Matthew Leybourne, Nick V Grishin, Hong Zhang BMC Structural Biology 2006, 6:27 (23 December 2006)

Abstract | Full text | PDF | PubMed |  Editor’s summary

The mysterious NIF3-like protein family may help regulate nitrogen, a prediction supported by a Staphylococcus aureus protein structure consisting of a hexameric ring of NIF3 domains with a ligand bound at a metal site.

72.

5494
Accesses

Research article   Open Access Highly Accessed

Molecular modeling of the reductase domain to elucidate the reaction mechanism of reduction of peptidyl thioester into its corresponding alcohol in non-ribosomal peptide synthetases

Balachandran Manavalan, Senthil K Murugapiran, Gwang Lee, Sangdun Choi BMC Structural Biology 2010, 10:1 (12 January 2010)

Abstract | Full text | PDF | PubMed

73.

5431
Accesses

Research article   Open Access Highly Accessed

Modelling substrate specificity and enantioselectivity for lipases and esterases by substrate-imprinted docking

P Benjamin Juhl, Peter Trodler, Sadhna Tyagi, Jürgen Pleiss BMC Structural Biology 2009, 9:39 (3 June 2009)

Abstract | Full text | PDF | PubMed

74.

5424
Accesses

Research article   Open Access

A comprehensive analysis of 40 blind protein structure predictions

Ram Samudrala, Michael Levitt BMC Structural Biology 2002, 2:3 (1 August 2002)

Abstract | Full text | PDF | PubMed | Cited on BioMed Central

75.

5394
Accesses

Research article   Open Access

X-ray sequence and crystal structure of luffaculin 1, a novel type 1 ribosome-inactivating protein

Xiaomin Hou, Minghuang Chen, Liqing Chen, Edward J Meehan, Jieming Xie, Mingdong Huang BMC Structural Biology 2007, 7:29 (30 April 2007)

Abstract | Full text | PDF | PubMed

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