Friday 14 December 2012

PROTEIN DATA BANK(PDB)

Assalamu'alaikum ....

For this post, we will share a brief information about ..

"PROTEIN DATA BANK"

Do you know what is PDB?...


It is actually a repository for 3-D  biological macromolecular structure
It includes proteins,nucleic acids and viruses. PDB is obtained by X-Ray crystallography (80%) or NMR spectroscopy (16%) and all data are available to the public.This structure is actually submitted by biologists and biochemists from around the world.


PDB was founded in 1971 by Brookhaven National Laboratory, New York. The first set of data were entered on punched cards. Then with magnetic tapes.After that it is  transferred to the Research Collaboratory for Structural Bioinformatics (RCSB) in 1998.Currently it holds 29,000 released structures.

PDB an important resource for research in the academic, pharmaceutical, and biotechnology sectors

Example:
  • Will this molecule turns into a cancer cell?
  • Can this combination of molecules cure common cold?
  • How does radiation affect the RNA and DNA?

Protein Images






Structure of Squash Trypsin Inhibitor:





Structure of the Alpha Amylase





Structure of Phospholipase





Structure of clpp:





PDB data format

PDB data format is used to contain the coordinates and related information . In the late 1990’s macromolecular Crystallographic Information file (mmCIF) evolved. It conforms to well-documented standards and facilitates automated data management

Software Tools

There are various software tools can minimize the amount of manual labor
It helps scientists deposit their results quicker and also help validate their results


Commonly used software:
Data Query

Search Fields Example
PDB ID
4HHB,2MHR
Contains Chain Type
Protein: IGNORE,Enzyme:YES
Citation Author
Stuart Taylor
Compound Information
Myoglobin
Number of chains
1-5
Structure Content
Present of Alpha

PDB Beta

Includes three tiers architecture: relational database, presentation 
tier and an object-relational J2EE middle tier. It also a
dded XML as a file format



Uses freely distributed Java components:
  • Lucene – Text indexing system
  • JfreeChart – Charts generation
  • Hibernate – Object/relational persistence
  • Jboss – J2EE application server

Data Integration


Users are interested in enzymes, diseases and others beside macro molecular structure.


External data are included in PDB Beta

  • Gene Ontology – Vocabularies of all known gene and protein
  • Enzyme Commission – Repository of Enzymes
  • KEGG Pathways – Molecule interaction networks




  • Data are collected and integrated weekly.


    > Visit Protien Data Bank Website: RCHB Protein Data Bank

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