Embrapa/CNPTIA
BioInformatics BrazilianBioNet (BBNet)/Brazilian BioInformatics Resource Center (BBRC) Goran Neshich's Lab |
&
|
Columbia University
Department of Biochemistry and Molecular Biophysics Barry Honig's Lab |
STING Millennium
Blue Star Suite
STING can be accessed from the following servers:
Brazil | http://www.cbi.cnptia.embrapa.br/ |
Brazil | http://asparagin.cenargen.embrapa.br/SMS/ |
USA | http://trantor.bioc.columbia.edu/SMS/ |
USA | http://mirrors.rcsb.org/SMS/ |
Spain | http://www.es.embnet.org/SMS/ |
Argentina | http://www.ar.embnet.org/SMS/ |
Japan | http://gibk26.bse.kyutech.ac.jp/SMS/ |
What is STING
Millennium?
STING
Millennium MODES
STING
Millennium MODULES
Sequence to
Graphics & Graphics to Sequence Easy Link
Browse and
find Local PDB-format files
STING
Millennium Windows
Known
bugs
External LINKS to SMS and its components
PDB_Metrix
Samples of STING
Millennium application
STING Millennium: Charge complementarity
on molecular interfaces
STING Millennium: Protein/DNA
Interface and Structural Waters
STING
Millennium: Ligand Pocket and Coordinating Residues
STING
Millennium: Ramachanran plot
Get results
in Warp speed:
See other application
possibilities:
STING Millennium is a web based suite
of programs that starts with visualizing molecular structure and then leads
a user through a series of operations resulting in a comprehensive structure
analysis:
amino acid sequence and structure
positions,with emphasis on bi-directional coupling of sequence and 3D
information
pattern search, neighbors identification,
H-bonds, angles and distances
between atoms are easy to obtain thanks to the intuitive graphic and menu interface.
In addition, a user can obtain:
sequence to structure relationships,
analysis of a quality of the
structure,
nature and volume of atomic
contacts of intra and inter chain type,
analysis of amino acid relative
conservation at specified position among homologous proteins, and
Accessible Surface Area
relationship of relative conservation
to the intra-chain contacts
functional parameters deciphered
etc..
Such powerful combination of tools is available from a single site, eliminating needs for time-consuming data parsing. As a real treat, STING Millennium offers to the users a compilation of all these data through Protein Dossier module. |
STING Millennium can also be used
as an application that provides a user friendly interface allowing to analyze
several proteins at the
same time. The proteins previously superimposed, can be displayed simultaneously
and then analyzed. A user can compare active sites or any other relevant parts
of structural alignment.
STING Millennium has been developed
from original STING concept, however, we have completely rewritten all code
and made a STING concept much more versatile. In terms of the system design
the package is implemented using a variety of programming languages, each one
better suited to a specific task:
Chime® molecular visualization
plugin (MDL inc.) to provide the molecular rendering (discontinued)
Sequence window written in
Java™ that permits a complete control over the plugin and offers a series of
services
A JavaScript interface making
the bridge over the Java-plugin communication, which is specific for Netscape®
browsers
The PERL language is used as
a wrapper for processing web requests
The C++ classes are used for
more intensive programming tasks in structure parameter calculations
STING Millennium has several working
modes permitting its use with:
A single
PDB structure (either from a database or single modeled structure in PDB format)
A structural alignment of several
structures (structures previously aligned with CE or PRISM software)
A PDB structure
along with a sequence alignment, containing the respective PDB sequence.
This offers a way to visualize sequence conservation/variation and correlate it with structural regions in the target protein. The structure can also have its residues colored by an index that indicates sequence conservation (sequence entropy) promoting a rapid identification of the sites subject to differential selective pressure
Several analytical programs developed by our group are listed under the modules entry in the main menu. They perform several tasks providing a powerful combination of tools to analyze the given PDB structure. These modules are:
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STING Millennium Sequence to Graphics & Graphics to Sequence Easy Link
STING Millennium shows the sequence and maps the locations of sequence residues or residue ranges onto the 3D structure.
Sequence and Graphics Windows are interconnected so that the user
can have control of both types of information; With only one stroke ("click"
) on the chosen sequence residue, a user of the STING Millennium
can get a visual presentation of the 3D position of that residue within
the Macromolecular 3D structure!
A user can search the Graphics
Window and ask questions such as:
Which residue is at a particular spot - pointed by the mouse - within a 3D Window? & The user can place the mouse over a single letter code in the Sequence Window and ask question such as: Where in the 3D fold is this residue placed? |
In addition, the user has a complete information about a
sequence: numbering, gaps
and also PDB defined secondary structure
regions [Helices (red
lines below the sequence) and Extended Sheets (blue
lines below sequence)].
Browse and find
Local PDB-format files
The user can search for the right PDB file by using PDBMetrics.
Note: the user should realize that PDBMining will also offer "Sting
It" pointer option once right file is found. If that option is used, the
PDB copy of that file is accessed and displayed, ready for additional analysis.
After identifying PDB file to be analyzed, the user can simply type in 4 letter code of the right PDB file into the "Enter 4 letter code of the PDB format file. Then STING It!" field and press "Enter" key on the keyboard.
If the PDB formatted file is already located on local - client
- computer, this will significantly speed up STING Millennium presentation,
as PDB file will be accessed on local machine (eliminating delays due to
network downloading of the structure stored at the STING Millennium server
site).
The user can also browse local directories and search for the any PDB format
file (models).
If the user knows exact path and file name, this path and file name should
be entered into:"Local PDB file Name:" field, and then press "Sting It"
button below that same field.
If user does not know exact path and/or file name, "Browse" button should
be pressed and file name should be found. Once Browse option is completed,
the user is expected to press "Sting It" button just below the "Browse"
button. New browser will be opened and STING will display content of that
particular file.
STING
Millennium Windows
The STING Millennium has 2 main windows:
Graphics Window , showing 3D structure
and
Sequence Window which contains the linear
protein/DNA sequence, color coded with respect to Hydrophobicity and charged
groups! This window also contains STING Millennium Control Menu.
The Sequence Window also shows residue
numbers in the sequence, gaps
in the PDB sequence, chain identifier
and secondary structure elements
identifier. Each residue in the Sequence Window is "clickable",
resulting in CPK (or any of the 6 other types) presentation of its position
in 3D in the Graphics Window. Blue and Red lines below the sequence
are also "clickable" resulting in graphical RIBBON presentation of the specified
sequence region!
STING Millennium Status Frame ("Residue
Info:") is the area at the Sequence Window (just right
from the STING icon). The user can see residue/chain complete identification
while sliding the mouse over the sequence in the STING Millennium Sequence
Window, or while clicking the mouse's left button over atoms in STING
Millennium Graphics window.
STING Millennium Control Menu has a number of predefined
CHIME Scripts to be executed after pressing a button of choice; One can
easily:
**color code all charged residues,
**color code chains,
**select and display the ligand and
only water molecules in vicinity of the ligand;
**select and display ligand pocket (residues within 2 Angstroms from the
ligand) and finally,
**display (again using a single stroke = click on the button) the interface
between two chains!
Special attention should be given to STING Millennium Modules as they offer a wealth of information on protein structures and their sequences.