Award Abstract # 0706347
III-CXT: Collaborative Research: Integrated Modeling of Biological Nanomachines

NSF Org: IIS
Division of Information & Intelligent Systems
Recipient: UNIVERSITY OF WASHINGTON
Initial Amendment Date: August 6, 2007
Latest Amendment Date: August 6, 2007
Award Number: 0706347
Award Instrument: Standard Grant
Program Manager: Sylvia Spengler
sspengle@nsf.gov
 (703)292-7347
IIS
 Division of Information & Intelligent Systems
CSE
 Directorate for Computer and Information Science and Engineering
Start Date: August 1, 2007
End Date: July 31, 2009 (Estimated)
Total Intended Award Amount: $165,000.00
Total Awarded Amount to Date: $165,000.00
Funds Obligated to Date: FY 2007 = $165,000.00
History of Investigator:
  • David Baker (Principal Investigator)
    dabaker@u.washington.edu
Recipient Sponsored Research Office: University of Washington
4333 BROOKLYN AVE NE
SEATTLE
WA  US  98195-1016
(206)543-4043
Sponsor Congressional District: 07
Primary Place of Performance: University of Washington
4333 BROOKLYN AVE NE
SEATTLE
WA  US  98195-1016
Primary Place of Performance
Congressional District:
07
Unique Entity Identifier (UEI): HD1WMN6945W6
Parent UEI:
NSF Program(s): Info Integration & Informatics
Primary Program Source: app-0107 
Program Reference Code(s): 7364, 9216, HPCC
Program Element Code(s): 736400
Award Agency Code: 4900
Fund Agency Code: 4900
Assistance Listing Number(s): 47.070

ABSTRACT

Biological nanomachines are the assemblies that carry out all the basic biological processes in a living organism. Electron cryo-microscopy (cryoEM) is the most appropriate structural tool to determine molecular structures of biological nanomachines that generally consist of multiple protein subunits and/or nucleic acids with a total mass greater than 0.5 million Daltons. The goal is to develop information discovery and integration methodologies for deriving atomic models of nanomachines. Such models will be derived from 3-dimensional (3-D) cryoEM mass density function (i.e. a volumetric density map) in conjunction with physics of protein folding and informatics data. This project is made possible by an integration of the expertise of five investigators in computer graphics, computational biophysics, structural informatics and cryoEM. The intellectual merit of this research is highlighted by the computational approaches of extracting structural information from low-resolution, complex cryoEM volume densities and integrating this information into classical protein structure modeling paradigms, such as comparative modeling and ab initio modeling, for understanding biological nanomachines. The three research goals involve information discovery, information integration and validation of the proposed algorithms. The proposed research will have significant impacts in three disparate disciplines: computer science, molecular modeling, and cryoEM. Furthermore, the team will disseminate their resulting tools freely to the academic community and will host a workshop towards the end of the project. To enhance the impact of their research, the investigators will integrate research with education at each member institution with an eye towards diversity. In particular, these investigators will develop a virtual didactic course in modeling of biological nanomachines for graduate and senior undergraduate students at the five participating institutions.

PUBLICATIONS PRODUCED AS A RESULT OF THIS RESEARCH

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DiMaio, F; Tyka, MD; Baker, ML; Chiu, W; Baker, D "Refinement of Protein Structures into Low-Resolution Density Maps Using Rosetta" JOURNAL OF MOLECULAR BIOLOGY , v.392 , 2009 , p.181 View record at Web of Science 10.1016/j.jmb.2009.07.00

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