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Databases and Systems

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64<br />

3. to organize a database of all chemical compounds in the cell <strong>and</strong> link each<br />

compound to a pathway component, <strong>and</strong><br />

4.<br />

to develop computational technologies for pathway comparison, reconstruction,<br />

<strong>and</strong> analysis.<br />

KEGG is publicly made available as part of the Japanese GenomeNet Service [2].<br />

The WWW addresses that are relevant to this chapter are summarized in Table 1.<br />

Data Representation in KEGG<br />

Level of abstraction<br />

Table 1. The Japanese GenomeNet service<br />

As illustrated in Figure 1, a cysteine is a network of carbon, nitrogen, oxygen,<br />

hydrogen, <strong>and</strong> sulfur atoms at the atomic level, but it is abstracted to letter C at the<br />

molecular level where a protein is represented by a one-dimensional network of<br />

twenty letters (amino acids). In the next network level the protein is abstracted to a<br />

symbol, Ras, <strong>and</strong> the wiring among different symbols (proteins) is the major concern<br />

as in this case of Ras signal transduction pathway. Most of the current molecular<br />

biology databases contain the data at either the molecular level or the atomic level<br />

focusing on the information that is associated with protein <strong>and</strong> nucleic acid<br />

molecules, such as the sequence databases <strong>and</strong> the 3D structural databases.<br />

Consequently, the majority of the current computational methods in molecular<br />

biology involves comparison <strong>and</strong> analysis of sequence data or 3D atomic coordinate<br />

data. The main role of KEGG is to fill the gap at the network level by computerizing<br />

current knowledge of biochemical pathways <strong>and</strong> by developing associated<br />

computational technologies. KEGG also intends to fill another gap at the atomic<br />

level, which is the lack of good public resources for chemical compounds.

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