Scanned
the CMBI WHATIF Check Report
Found the Centre for Molecular Biomolecular Infomatics
site from PDBSum where I found some notes about tyrosine kinase's potential
deviations that would impact the interpretation of the structure. This database
is used for Homology Modeling and functions to detect mutant prediction and
structure verification. The records also include geometric uncertainties like
bad or erroneous torsion angle which could vitiate structural comparisons.
WHAT IF notes breaksdown potential warnings in an outline to review. Also
displays a Ramachandran plot of the selected protein as well as RMS Inside/Outside
z-Plot score.
Using GlaxoSmithKline DeepView / Swiss-PdbViewer
Found and downloaded this versatile tool that made
it easy to load a pdb file and tweak its structure. It warned that the structure
file has some missing side chains - something that was overlooked in Rasmol.
This application is more robust because it has the ability to color force
field energy, threading energy; it can also fix selected side chains.
Using
Molmovdb...
Downloaded the
animated gifs for my pet protein from the Database of MacroMolecular Movements
which contain a library of protein motions.
Morphing Motions Rankable Stats
Searching
the Enzyme Structure Database (ESDB)
As well as using NCBI's EC (Enzyme Classification)
tool and came across ESDB classification database that proved equally useful
in hunting through the layers of enzymes classification groups. The
database contains known enzyme structures stored in PDB at Brookhaven. Just
like EC a ESDB using a Enzyme Classification number. For Tyrosine
Kinase, this number is: EC2.7.1.112.
Direct Link to Enzyme Class for Tyrosine Kinase
Investigating
the EMBL-EBI database
Using the Fold classification based on Structure-Structure
alignment of Proteins (FSSP) I came across 65 matches when searching for
Tyrosine Kinase. FSSP is an all-to-all 3D structural comparison database
that uses the DALI search engine to process the searches.
Also
checked out EMBL-EBI's MSD
Searched
EBI and found the link to MSD
(Macromolecular Structure Database) and looked at the likely quartenary
structure or macromolecular assembly for Tyrosine Kinase. It summarizes the
information in a test for crystal packing.
Searching
in the ExPaSy databases
Started using Enzyme Commission Classification
Scheme (PROWL)
which linked me to ExPaSy database. After selecting the correct class and group,
I then checked ExPasy's NiceZyme view to compare entries in the ESDB database
to determine other cross references. This is the results I got when performing
a search:
Visted the
WIS Bioinformatics site
This site
maintained by the Weizmann
Institute of Science, Bioinformatics and Biological Computing department
is a site which also a good resource for finding relevant sites. This site
maintained information found in most of the other sites but formatted differently.
I easily found my ligand for my protein at this site.