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Plenarvorträge - DPG-Tagungen

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Symposium Life Sciences on the Nanometer Scale - Physics Meets Biology Mittwoch<br />

SYLS 3.15 Mi 16:00 B<br />

Acid-attack on Dental Enamel Investigated by Scanning Force<br />

Microscopy — •N. Schwender 1 , F. Al Marrawi 2 , K. Huber 2 , M.<br />

Hannig 2 , and C. Ziegler 1 — 1 Department of Physics, University of<br />

Kaiserslautern — 2 Department of Operative Dentistry and Periodontology,<br />

Saarland University<br />

As food or drinks always contain acids knowledge about the interaction<br />

of acids with dental enamel is important in preventive dentistry.<br />

Using the possibilities of Scanning Force Microscopy (SFM), the influence<br />

of acids on enamel surfaces was therefore investigated here. For<br />

this purpose, bovine enamel samples were ground flat, polished or cut<br />

by a diamond knife. Samples were treated with different acids such as<br />

phosphoric, citric, or hydrochloride acid, systematically changing the exposure<br />

time and the pH-value. Typical etch-patterns with a variation<br />

of height from the nano- to the micrometer scale as a result of mineral<br />

loss was observed. Distinct differences between the different acids could<br />

be observed which will be discussed taking into account the different reactivity<br />

of the components of enamel. Furthermore, the etched enamel<br />

shows a loss in stability and hardness noted by the erosion induced by<br />

the cantilever. In a further step the adsorption of saliva proteins such<br />

as BSA and lysozym on the etched surface compared to the undestroyed<br />

surface was investigated.<br />

SYLS 3.16 Mi 16:00 B<br />

Towards a near-field optical observation of single particle<br />

transport through an unsupported cell membrane — •Simone<br />

Johnas 1 , Christiane Höppener 2 , and Andreas Naber 1 —<br />

1 Institut für Angewandte Physik, Wolfgang-Gaede-Str. 1, Universität<br />

Karlsruhe (TH), 76131 Karlsruhe — 2 Physikalisches Institut,<br />

Wilhelm-Klemm-Str. 10, Universität Münster, 48149 Münster<br />

Highly differentiated macromolecular protein assemblies, so-called nuclear<br />

pore complexes (NPC), are embedded in the nuclear envelope (NE)<br />

of a eukaryotic cell and tightly control the exchange of all kinds of<br />

molecules between cytoplasm and nucleus. Since the NPCs are densely<br />

packed in the membrane, conventional optical microscopy is not able to<br />

distinguish between neighboring NPCs. By means of scanning near-field<br />

optical microscopy (SNOM) we have recently attained an optically resolved<br />

fluorescence image of dye-labeled NPCs in a functionally intact<br />

NE for the first time [1, 2]. Since SNOM enables us to address single<br />

NPCs, we are now aiming at a time-resolved observation of single transport<br />

events. A major obstacle towards this goal is the need of two compartments<br />

below and above the NE that mimics its natural environment.<br />

We will discuss possible preparation techniques and ways to image a freestanding<br />

membrane in a buffer solution with a SNOM. [1] C. Höppener,<br />

D. Molenda, H. Fuchs, and A. Naber, J. Microsc. 210, 288 (2002). [2]<br />

Contribution of C. Höppener et al. in this symposium.<br />

SYLS 3.17 Mi 16:00 B<br />

Biological photonic crystals — •Thomas Fuhrmann, Melanie El<br />

Rharbi-Kucki, and Stefan Landwehr — Makromolekulare Chemie<br />

und Molekulare Materialien, Fachbereich Naturwissenschaften und Center<br />

for Interdisciplinary Nanostructure Science and Technology, Universität<br />

Kassel<br />

Active and passive photonic crystals are interesting for a wide range<br />

of applications. We show that photonic crystal structures for visible light<br />

can be found in centric diatoms which exhibit a very efficient photosynthesis.<br />

We present electromagnetic wave calculations addressing the<br />

photonic structure of the algae cells and experimental results about the<br />

light distribution in the cell.<br />

SYLS 3.18 Mi 16:00 B<br />

Density functional theory study of alpha-helical polypeptides<br />

under tensile strain — •Joel Ireta 1 , Jörg Neugebauer 1,2 ,<br />

and Matthias Scheffler 1 — 1 Fritz-Haber-Institut der Max-<br />

Planck-Gesellschaft, Berlin — 2 Theoretische Physik, Universität<br />

Padeborn<br />

Recent experimental techniques employing e. g. optical tweezers or<br />

atomic force microscopes make it possible to monitor the behavior of<br />

biopolymers under tensile strain. Using this technique force-driven phase<br />

transitions occurring at single molecule level have been observed. While<br />

such studies give important information they are (presently) not able<br />

to provide insight into the atomistic details of such processes. We have<br />

therefore studied the mechanical response of infinite polyalanine and<br />

polyglicine chains in alpha-helical conformation since these structures<br />

represent the smallest but still realistic models of a protein. We employ<br />

density functional theory, ab initio pseudopotentials and the Perdew-<br />

Burke-Ernzerhof formulation for the exchange and correlation functional.<br />

Calculating the response force along the helix axis as function of strain,<br />

we have identified a plateau region at forces of about 25 pN. The presence<br />

of a plateau is characteristic for a first order phase transition. An analysis<br />

of the helical structures shows that sizeable changes in the covalent bonds<br />

of the peptide unit (particularly carbon and nitrogen pyramidalization)<br />

are the driving force causing the phase transition.<br />

SYLS 3.19 Mi 16:00 B<br />

Carbon nanotube-assisted microwave absorption of gold<br />

nanoparticles across bacterial membranes — •Jose Rojas-<br />

Chapana 1 , Miguel Correa-Duarte 1 , Neli Sobal 1 , Krzysztof<br />

Kempa 2 , and Michael Giersig 1 — 1 Caesar Research Center,<br />

Ludwig-Erhard Allee 2, 53175 Bonn — 2 Boston College, Boston, MA,<br />

USA<br />

Acidothiobacillus ferrooxidans an acid tolerant bacterium was used as<br />

a tool to study intracellular incorporation and storage of gold nanoparticles<br />

(GN) induced by carbon nanotubes (CNTs). The microwave (MW)<br />

irradiation induced an electrostatic charge in the CNTs. Under this condition<br />

all the single CNTs work as an electric dipole. The addition of a<br />

small concentration of CNTs to a medium containing both bacteria and<br />

GN, and subsequent MW-irradiation leads to intracellular transport of<br />

gold without altering the viability of bacterial cells. As is shown by the<br />

transmission electron microscopy (TEM) examination, CNT tip heads are<br />

very close to the cell wall of bacteria. This CNTs-cell electrical contact<br />

is a prerequisite for the onset of temporary channels. One of the possible<br />

mechanisms during the MW-irradiation is a local electrical dipole<br />

induced in CNTs which leads to cell-wall destabilization, having the dimension<br />

of the CNTs tip heads (ca.30 nm diameter), which in turn act as<br />

a channel for the transport of gold. The occurrence of this phenomenon,<br />

as documented by TEM images, constitutes the most important factor<br />

facilitating MW-induced transport of GN across the cells.<br />

SYLS 3.20 Mi 16:00 B<br />

Quantum Monte Carlo study of small molecules and hydrogen<br />

bonded model systems - benchmarking density functionals —<br />

•M. Fuchs 1 , A. Badinski 1 , J. Ireta 1 , P. Kratzer 1 , C. Filippi<br />

2 und M. Scheffler 1 — 1 Fritz-Haber-Institut der MPG, Berlin —<br />

2 Instituut Lorentz, Univ. Leiden<br />

Diffusion Monte Carlo (DMC) calculations can be useful to validate<br />

(and correct) results from density-functional theory (DFT) where manyelectron<br />

correlations must be approximated. DMC is not yet a routine<br />

tool however, partly because experience to corroborate its robustness is<br />

still scarce. Here we apply the pseudopotential fixed-node DMC method<br />

to (i) selected small molecules and (ii) model systems for hydrogen bonds,<br />

the latter playing a key role for the structure and functionality of, e.g.,<br />

biomolecules. We carefully monitor how DMC performs dependent on<br />

(nonlocal) pseudopotentials and on the optimization of the initial trial<br />

wavefunction. We find that both aspects can be nontrivial, even for the<br />

simple N2 diatomic. For finite formamide chains our DMC data show<br />

that the cooperative increase of the H-bond strength in longer chains is<br />

best reproduced in DFT using the PBE gradient corrected functional.<br />

Our findings support a recent DFT study of the stabilization of α helical<br />

polyalanine which found an unusually large cooperativity of the H-bonds<br />

[J. Ireta et al., J. Phys. Chem. B 107, 1432 (2003)].<br />

SYLS 3.21 Mi 16:00 B<br />

Conformational flexibility of pigment-protein complexes<br />

studied by optical single-molecule spectroscopy — •Silke<br />

Oellerich 1 , Martijn Ketelaars 1 , Jean-Manuel Segura 1 ,<br />

Ward P.F. de Ruijter 1 , Richard J. Cogdell 2 , and Thijs J.<br />

Aartsma 1 — 1 Dept. of Biophysics, Leiden University, Niels Bohrweg 2,<br />

2333 CA Leiden, The Netherlands — 2 Dept. of Biochemistry, University<br />

of Glasgow, Scotland<br />

Low temperature, optical single-molecule spectroscopy was employed<br />

to study the conformational flexibility and its effect on the electronic<br />

properties of individual pigment-protein complexes. We studied the bacterial<br />

light-harvesting complex 3 (LH3), which consists of 27 bacteriochlorophyll<br />

a (BChl a) pigments and exhibits a heterogeneous spectral<br />

behaviour at the single-molecule level. The applied technique provides<br />

information about both the interaction between the pigments within a<br />

complex as well as the effect of the local environment on an individual pigment.<br />

We show that the spectral heterogeneity is caused by light-induced<br />

conformational changes of individual BChl a pigments which affect the

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