1jcv

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(New page: 200px<br /><applet load="1jcv" size="450" color="white" frame="true" align="right" spinBox="true" caption="1jcv, resolution 1.55&Aring;" /> '''REDUCED BRIDGE-BROKE...)
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[[Image:1jcv.gif|left|200px]]<br /><applet load="1jcv" size="350" color="white" frame="true" align="right" spinBox="true"
caption="1jcv, resolution 1.55&Aring;" />
caption="1jcv, resolution 1.55&Aring;" />
'''REDUCED BRIDGE-BROKEN YEAST CU/ZN SUPEROXIDE DISMUTASE LOW TEMPERATURE (-180C) STRUCTURE'''<br />
'''REDUCED BRIDGE-BROKEN YEAST CU/ZN SUPEROXIDE DISMUTASE LOW TEMPERATURE (-180C) STRUCTURE'''<br />
==Overview==
==Overview==
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The three-dimensional structure of yeast copper-zinc superoxide dismutase, (CuZnSOD) has been determined in a new crystal form in space group R32 and, refined against X-ray diffraction data using difference Fourier and, restrained crystallographic refinement techniques. The unexpected result, is that the copper ion has moved approximately 1 angstrom from its, position in previously reported CuZnSOD models, the copper-imidazolate, bridge is broken, and a roughly trigonal planar ligand geometry, characteristic of Cu(I) rather than Cu(II) is revealed. Final R values for, the two nearly identical room temperature structures are 18.6% for all 19, 149 reflections in the 10.0-1.7 angstrom resolution range and 18. 2% for, 17 682 reflections (F &gt; 2 sigma) in the 10.0-1.73 angstrom resolution, range. A third structure has been determined using X-ray data collected at, -180 degrees C. The final R value for this structure is 19.0% (R(free) =, 22.9%) for all 24 356 reflections in the 10.0-1.55 angstrom resolution, range. Virtually no change in the positions of the ligands to the zinc, center is observed in these models. The origin of the broken bridge and, altered Cu-ligand geometry is discussed.
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The three-dimensional structure of yeast copper-zinc superoxide dismutase (CuZnSOD) has been determined in a new crystal form in space group R32 and refined against X-ray diffraction data using difference Fourier and restrained crystallographic refinement techniques. The unexpected result is that the copper ion has moved approximately 1 angstrom from its position in previously reported CuZnSOD models, the copper-imidazolate bridge is broken, and a roughly trigonal planar ligand geometry characteristic of Cu(I) rather than Cu(II) is revealed. Final R values for the two nearly identical room temperature structures are 18.6% for all 19 149 reflections in the 10.0-1.7 angstrom resolution range and 18. 2% for 17 682 reflections (F &gt; 2 sigma) in the 10.0-1.73 angstrom resolution range. A third structure has been determined using X-ray data collected at -180 degrees C. The final R value for this structure is 19.0% (R(free) = 22.9%) for all 24 356 reflections in the 10.0-1.55 angstrom resolution range. Virtually no change in the positions of the ligands to the zinc center is observed in these models. The origin of the broken bridge and altered Cu-ligand geometry is discussed.
==About this Structure==
==About this Structure==
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1JCV is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Saccharomyces_cerevisiae Saccharomyces cerevisiae] with CU and ZN as [http://en.wikipedia.org/wiki/ligands ligands]. Active as [http://en.wikipedia.org/wiki/Superoxide_dismutase Superoxide dismutase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.15.1.1 1.15.1.1] Full crystallographic information is available from [http://ispc.weizmann.ac.il/oca-bin/ocashort?id=1JCV OCA].
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1JCV is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Saccharomyces_cerevisiae Saccharomyces cerevisiae] with <scene name='pdbligand=CU:'>CU</scene> and <scene name='pdbligand=ZN:'>ZN</scene> as [http://en.wikipedia.org/wiki/ligands ligands]. Active as [http://en.wikipedia.org/wiki/Superoxide_dismutase Superoxide dismutase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.15.1.1 1.15.1.1] Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1JCV OCA].
==Reference==
==Reference==
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[[Category: Single protein]]
[[Category: Single protein]]
[[Category: Superoxide dismutase]]
[[Category: Superoxide dismutase]]
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[[Category: Eisenberg, D.S.]]
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[[Category: Eisenberg, D S.]]
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[[Category: Hart, P.J.]]
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[[Category: Hart, P J.]]
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[[Category: Ogihara, N.L.]]
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[[Category: Ogihara, N L.]]
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[[Category: Parge, H.E.]]
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[[Category: Parge, H E.]]
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[[Category: Tainer, J.A.]]
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[[Category: Tainer, J A.]]
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[[Category: Valentine, J.S.]]
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[[Category: Valentine, J S.]]
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[[Category: Weiss, M.S.]]
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[[Category: Weiss, M S.]]
[[Category: CU]]
[[Category: CU]]
[[Category: ZN]]
[[Category: ZN]]
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[[Category: zinc]]
[[Category: zinc]]
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''Page seeded by [http://ispc.weizmann.ac.il/oca OCA ] on Tue Nov 20 18:07:00 2007''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 13:21:16 2008''

Revision as of 11:21, 21 February 2008


1jcv, resolution 1.55Å

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REDUCED BRIDGE-BROKEN YEAST CU/ZN SUPEROXIDE DISMUTASE LOW TEMPERATURE (-180C) STRUCTURE

Overview

The three-dimensional structure of yeast copper-zinc superoxide dismutase (CuZnSOD) has been determined in a new crystal form in space group R32 and refined against X-ray diffraction data using difference Fourier and restrained crystallographic refinement techniques. The unexpected result is that the copper ion has moved approximately 1 angstrom from its position in previously reported CuZnSOD models, the copper-imidazolate bridge is broken, and a roughly trigonal planar ligand geometry characteristic of Cu(I) rather than Cu(II) is revealed. Final R values for the two nearly identical room temperature structures are 18.6% for all 19 149 reflections in the 10.0-1.7 angstrom resolution range and 18. 2% for 17 682 reflections (F > 2 sigma) in the 10.0-1.73 angstrom resolution range. A third structure has been determined using X-ray data collected at -180 degrees C. The final R value for this structure is 19.0% (R(free) = 22.9%) for all 24 356 reflections in the 10.0-1.55 angstrom resolution range. Virtually no change in the positions of the ligands to the zinc center is observed in these models. The origin of the broken bridge and altered Cu-ligand geometry is discussed.

About this Structure

1JCV is a Single protein structure of sequence from Saccharomyces cerevisiae with and as ligands. Active as Superoxide dismutase, with EC number 1.15.1.1 Full crystallographic information is available from OCA.

Reference

Unusual trigonal-planar copper configuration revealed in the atomic structure of yeast copper-zinc superoxide dismutase., Ogihara NL, Parge HE, Hart PJ, Weiss MS, Goto JJ, Crane BR, Tsang J, Slater K, Roe JA, Valentine JS, Eisenberg D, Tainer JA, Biochemistry. 1996 Feb 20;35(7):2316-21. PMID:8652572

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