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After the expression of the titin-Hsp27-construct with the following purification supplies no satisfied results which makes the realization of the atomic force microscopy not possible. The devel-opment of the structure model by using different bioinformatic methods can establish a model for the protein sequence. As bioinformatic methods the template search by different BLAST runs and free available software like SwissModel, Pcons, ModWeb and other tools are used. Nevertheless, the generated model is not the native conformation and has to be analyzed with other software until a stable conformation of the structure can be predicted. Depending on the time which is provided the generated model is a good approach for the aim this master thesis has.
There are a lot of people taking part in more than one competition. The competitions are also of a different kind. From local events with a small number of participants to international tournaments watched by many viewers. Naturally it becomes necessary a system to assess and compare the success in various competitions.
The existing ranking systems are usually specialized to fit their application area. More general ranking methods also exist. They can be applied to a wide spectrum of competition fields. However these ranking methods are still not universal and don't cover some important features of the competitions.
A totally new ranking system has been developed within the present master thesis. Its primary purpose is to evaluate and measure prestige gained by participants in competitions. The main contribution of the thesis consists of an original mathematical model that makes the ranking system unique.
The developed ranking system claims to be universal and interdisciplinary. It is based on the fundamental element that distinguishes the competition from the non-competition areas, namely standings that rank the participants according to their performance. The universality and the interdisciplinarity of the ranking system make available cross-disciplinary comparisons, which is usually very subjective and difficult for implementation.
The contribution of the master thesis extends beyond the theoretical area. A ranking software that fully implements this novel ranking system has been designed and developed. The software makes the practical benefits of the ranking system immediately available to potential application areas such as sports clubs and universities.
And finally, the developed ranking system offers a new viewpoint to the competitions – as a way of gaining prestige, rather than the traditional viewpoint of demonstrating mastery.
Proteins are involved in almost every aspect of life, mediating a wide range of cellular tasks. The protein sequence dictates the spatial arrangement of the residues and thus ultimately the function of a rotein. Huge effort is put into cumbersome structure eludication experiments which obtain models describing the observed spatial conformation of a protein, enabling users to predict their function, to understand their mode of action or to design tailored drugs to cure disease caused by misfolded or misregulated proteins.
However, the result of structure determination experiments are merely models of reality, made under simplifying assumptions - sometimes containing major undetected errors. On the other hand, such experiments are resource demanding and they cannot supply the actual demand.
Thus, scientists are predicting the structure of proteins in silico, resulting in models that are even
more prone to error.
In consequence, the structure biologists search after a practicable definition of structure quality and over the last two decades several model quality assessment programs emerged, measuring the local and global quality of peculiar structures. Seven representatives were studied, regarding the paradigms they follow and the features they use to describe the quality of residues. Their predications were compared, showing that there is almost no common ground among the tools.
Is there a way to combine their statements anyway?
Finally, the accumulated knowledge was used to design a novel evaluation tool, addressing problems previously spotted. Thereby, high quality of its predication as well as superior usability was
key. The strategy was compared to existing approaches and evaluated on suitable datasets.
The bachelor thesis is about cis-trans isomerization of Xaa-Pro (Xaa = any amino acid), their quantitative acquisition and the selection of 3D structure information for the prediction with a support vector machine (SVM). The quantitative detection of occurrence of cis-, trans- and cis/trans conformation in membrane proteins will be examined and evaluated. The 3D structure informa-tions include 12 features, the amino acids around proline and are including of proline. These include the inside/outside classification, the real secondary structure, energy consideration, as well as five further amino acid occur properties within a defined radius of the proline. From this information, a data set was created for the SVM. This program is used for the prediction of unknown and known Xaa Pro Isomerisms. The methods for the analysis were implemented with the platform independent programming language Java. Two programs have emerged from the work to a Xaa PIPT for the quantitative detection and extracting structural information and m Xaa-PIPT to the pure prediction of Xaa-Pro isomerism in protein structures. 389 Membrane proteins from the PDB (Protein Data Bank) served as a basis. The data were also statistically analysed and evaluated.
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The cultivation of mammalian cells in the third dimension has a great potential for a
wide application in regenerative medicine, pharmaceutical industry or cancer research.
An overview about actual 3-D cultivation techniques like hydrogels and porous scaffolds as well as their various materials and modifications is given in this thesis. Also different products and their implementation for a new application of 3-D cell
culture in a laboratory are described.
Proteins are macromolecules that consist of linear-bonded amino acids. They are essential elements in various metabolic processes. The three-dimensional structure of a protein is determined by the order of amino acids, also referred to as the protein sequence. This conformation corresponds to the structural state in which the protein is functionally active. However, relationships between protein sequence, structure and function have not been fully understood yet. Additionally, information about structural properties or even the entire protein structure are crucial for understanding the dynamics that define protein functionality and mechanisms. From this, the role of a protein in its molecular context can be described closely. For instance, interactions can be investigated and comprehended as a biological dynamic network that is sensitive to alternations, i.e. changes which are caused by diseases. Such knowledge can aid in drug design, whereas compounds need to be specifically tailored and adjusted to their molecular targets. Protein energy profile-basedmethods can be applied to investigate protein structures concerning dynamics and alternations. The publications enclosed to this work discuss in general the scientific potentials of energy profilebased techniques and algorithms. On the one hand, changes in stability caused by protein mutations and proteinligand interactions are discussed in the context of energy profiles. On the other hand, energetic relations to protein sequence, structure and function are elucidated in detail. Finally, the presented discussions focus on recent enhancements of the eProS (energy profile suite) database and toolbox. eProS freely provides all elucidated methodologies to the scientific community. Thus, one can address biological questions with the presented methods at hand. Additionally, eProS provides annotations related to foreign databases. This ensures a broad view on biological data and information. In particular, energetic characteristics can be identified which contribute to a protein’s structure and function.
The primary objective of this work and the research at the “Helmholtz-Zentrum für Umweltforschung” was to gain a deeper understanding of the basically transformation processes, especially for nitrogen species, in constructed wetlands. Therefore two different types of laboratory scale model systems, run with two different artificial wastewaters, had been observed for about 4 months. Data about the situation of three nitrogen species (ammonium, nitrate, nitrite), the physical condition of the pore water and the carbon sources contained by the water had been collected and compared. The present work will provide a summary about the actual knowledge of the microbial processes in constructed wetlands and the general character of such constructions. It will explain the different methods used to gain the data which will be later wards discussed with the aid of the created graphs in the final argumentation.