James Gumbart
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Home Department: Physics
Email:
gumbart@ks.uiuc.edu Telephone:
217-244-4361 Theoretical
and Computational Biophysics Group |
Education:
- Ph.D. in Physics, University of Illinois, Urbana-Champaign, April 2009
- M.S. in Physics, University of Illinois, Urbana-Champaign, October 2005
- B.S. in Physics and Mathematics, Western Illinois University, May 2003
Research Interests:
I am currently investigating the transport properties of the membrane channel SecY. SecY is part of a three-protein complex that serves to allow proteins to cross membranes or insert into them. This task is so important that a form of the Sec system exists in each domain of life! More information about this dynamic and multi-functional protein can be found at our Protein Translocation website. |
Another interesting problem is how Gram-negative bacteria (those possessing two membranes surrounding them) import large nutrients across the outer membrane. Since they cannot generate energy at the outer membrane, they possess an inner membrane protein, TonB, that couples across the periplasm to an outer membrane transporter in order to import large molecules, such as vitamin B12. The mechanisms of this interaction and how it causes transport are still open questions in the field of microbiology. |
Photosynthesis is an elemental process of nature and occurs not just in plants, but also in some bacteria as well. In these bacteria, membrane-bound pseudo-organelles known as chromatophores contain the proteins necessary to turn sunlight into chemical energy. These chromatophores come in different shapes depending on the organism but no one knows how they self-assemble into spheres or sheets, one question we now hope to answer. |
Publications:
Structure of monomeric yeast and mammalian Sec61 complexes interacting with the translating ribosome. Thomas Becker, Elisabet Mandon, Shashi Bhushan, Alexander Jarasch, Jean-Paul Armache, Soledad Funes, Fabrice Jossinet, James Gumbart, Thorsten Mielke, Otto Berninghausen, Klaus Schulten, Eric Westhof, Reid Gilmore, and Roland Beckmann. Science, 2009. Published online October 29 2009; 10.1126/science.1178535.
Membrane curvature induced by aggregates of LH2s and monomeric LH1s. Danielle E. Chandler, James Gumbart, John D. Stack, Christophe Chipot, and Klaus Schulten. Biophysical Journal, 97, 2009. In press.
Regulation of the protein-conducting channel by a bound ribosome. James Gumbart, Leonardo G. Trabuco, Eduard Schreiner, Elizabeth Villa, and Klaus Schulten. Structure, 17:1453-1464, 2009.
Coupling of calcium and substrate binding through loop alignment in the outer membrane transporter BtuB. James Gumbart, Michael C. Wiener, and Emad Tajkhorshid. Journal of Molecular Biology, 393:1129-1142, 2009.
Molecular mechanisms of active transport across the cellular membrane. Po-Chao Wen, Zhijian Huang, Giray Enkavi, Yi Wang, James Gumbart, and Emad Tajkhorshid. In Philip Biggin and Mark Sansom, editors, Molecular Simulations and Biomembranes: From Biophysics to Function. Royal Society of Chemistry, 2009.
Protein-induced membrane curvature investigated through molecular dynamics flexible fitting. Jen Hsin, James Gumbart, Leonardo G. Trabuco, Elizabeth Villa, Pu Qian, C. Neil Hunter, and Klaus Schulten. Biophysical Journal, 97:321-329, 2009.
Molecular dynamics simulations of membrane channels and transporters. Fatemeh Khalili-Araghi, James Gumbart, Po-Chao Wen, Marcos Sotomayor, Emad Tajkhorshid, and Klaus Schulten. Current Opinion in Structural Biology, 19:128-137, 2009.
The roles of pore ring and plug in the SecY protein-conducting channel. James Gumbart and Klaus Schulten. Journal of General Physiology, 132:709-719, 2008.
Intrinsic curvature properties of photosynthetic proteins in chromatophores. Danielle Chandler, Jen Hsin, Christopher B. Harrison, James Gumbart, and Klaus Schulten. Biophysical Journal, 95:2822-2836, 2008.
Long time and large size molecular dynamics simulations made feasible through new TeraGrid hardware and software. Kirby Vandivort, James C. Phillips, Elizabeth Villa, Peter L. Freddolino, James Gumbart, Leonardo G. Trabuco, Danielle E. Chandler, Jen Hsin, Christopher B. Harrison, Laxmikant Kale, and Klaus Schulten. Proceedings of the 2008 TeraGrid Conference, 2008.
Structural determinants of lateral gate opening in the protein translocon. James Gumbart and Klaus Schulten. Biochemistry, 46:11147-11157, 2007.
Mechanics of force propagation in TonB-dependent outer membrane transport. James Gumbart, Michael C. Wiener, and Emad Tajkhorshid. Biophysical Journal, 93:496-504, 2007.
Molecular dynamics studies of the archaeal translocon. James Gumbart and Klaus Schulten. Biophysical Journal, 90:2356-2367, 2006.
Scalable molecular dynamics with NAMD. James C. Phillips, Rosemary Braun, Wei Wang, James Gumbart, Emad Tajkhorshid, Elizabeth Villa, Christophe Chipot, Robert D. Skeel, Laxmikant Kale, and Klaus Schulten. Journal of Computational Chemistry, 26:1781-1802, 2005.
Molecular dynamics simulations of proteins in lipid bilayers. James Gumbart, Yi Wang, Alekseij Aksimentiev, Emad Tajkhorshid, and Klaus Schulten. Current Opinion in Structural Biology, 15:423-431, 2005.
Lectures and Poster Presentations (conferences and workshops):
(Talk) Regulation of the Protein-conducting Channel by a Bound Ribosome. James Gumbart, Leonardo G. Trabuco, Elizabeth Villa, Eduard Schreiner, Christopher B. Harrison, and Klaus Schulten. Biophysical Society Meeting, 2009. Boston, MA. |
(Poster) Coupling of Ca2+ and Substrate Binding in the Outer Membrane Transporter BtuB. James Gumbart, Michael C. Wiener, and Emad Tajkhorshid. Biophysical Society Meeting, 2009. Boston, MA. |
(Talk) Membrane Protein Insertion in the Translocon. James Gumbart and Klaus Schulten. CECAM Workshop on Membrane Protein Assembly: Theory and Experiment, 2008. Lausanne, Switzerland. |
(Poster) The Roles of the Pore Ring and the Plug in the SecY Protein-conducting Channel. James Gumbart and Klaus Schulten. Biophysical Society Meeting, 2008. Long Beach, CA. |
(Poster) Computational Studies of Substrate-dependent Behavior of the E. coli Cobalamin Transporter BtuB. James Gumbart, Christian Banchs, Michael C. Wiener, and Emad Tajkhorshid. Biophysical Society Meeting, 2008. Long Beach, CA. |
(Talk) Mechanics of force propagation in TonB-dependent outer membrane transporters. James Gumbart, Michael Wiener, and Emad Tajkhorshid. Biophysical Society Meeting, 2007. Baltimore, MD. |
(Poster) Opening of the Lateral Gate of the Translocon SecY. James Gumbart and Klaus Schulten. Biophysical Society Meeting, 2007. Baltimore, MD. |
(Poster) Dynamics of the Translocon SecY Investigated Through MD. James Gumbart and Klaus Schulten. Biophysical Society Meeting, 2006. Salt Lake City, UT. |
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(Poster) Optimal perturbations of a finite-width mixing layer near the trailing edge. James Gumbart and James Rabchuk. American Physical Society Meeting, 2002. Indianapolis, IN. |
Teaching:
Physics 550, Molecular Biophysics. Spring, 2006, 2008, 2009. |
Physics 598NSM, Non-equilibrium Statistical Mechanics, Fall 2007. |
Computational
Biophysics Workshop. NIH, Bethesda, MD, Nov. 2007. |
Computational
Biophysics Workshop. Pittsburgh, Pennsylvania, Nov. 2006. |
Computational
Biophysics Workshop. Frankfurt, Germany, Mar. 2006. |
Computational
Biophysics Workshop. Pittsburgh, Pennsylvania, Nov. 2005. |
Computational
Biophysics Workshop. Lake Tahoe, California, May 2005. |
Computational
Biophysics Workshop. Boston, Massachusetts, Dec. 2004. |
Physics 112 (now 212). Fall, 2003. |
