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1qi9

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[[Image:1qi9.jpg|left|200px]]<br /><applet load="1qi9" size="350" color="white" frame="true" align="right" spinBox="true"
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[[Image:1qi9.jpg|left|200px]]
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caption="1qi9, resolution 2.05&Aring;" />
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'''X-RAY SIRAS STRUCTURE DETERMINATION OF A VANADIUM-DEPENDENT HALOPEROXIDASE FROM ASCOPHYLLUM NODOSUM AT 2.0 A RESOLUTION'''<br />
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{{Structure
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|PDB= 1qi9 |SIZE=350|CAPTION= <scene name='initialview01'>1qi9</scene>, resolution 2.05&Aring;
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|SITE=
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|LIGAND= <scene name='pdbligand=VO4:VANADATE+ION'>VO4</scene> and <scene name='pdbligand=IOD:IODIDE ION'>IOD</scene>
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|ACTIVITY= [http://en.wikipedia.org/wiki/Chloride_peroxidase Chloride peroxidase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.11.1.10 1.11.1.10]
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|GENE=
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}}
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'''X-RAY SIRAS STRUCTURE DETERMINATION OF A VANADIUM-DEPENDENT HALOPEROXIDASE FROM ASCOPHYLLUM NODOSUM AT 2.0 A RESOLUTION'''
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==Overview==
==Overview==
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==About this Structure==
==About this Structure==
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1QI9 is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Ascophyllum_nodosum Ascophyllum nodosum] with <scene name='pdbligand=VO4:'>VO4</scene> and <scene name='pdbligand=IOD:'>IOD</scene> as [http://en.wikipedia.org/wiki/ligands ligands]. Active as [http://en.wikipedia.org/wiki/Chloride_peroxidase Chloride peroxidase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=1.11.1.10 1.11.1.10] Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1QI9 OCA].
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1QI9 is a [[Single protein]] structure of sequence from [http://en.wikipedia.org/wiki/Ascophyllum_nodosum Ascophyllum nodosum]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1QI9 OCA].
==Reference==
==Reference==
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X-ray structure determination of a vanadium-dependent haloperoxidase from Ascophyllum nodosum at 2.0 A resolution., Weyand M, Hecht H, Kiess M, Liaud M, Vilter H, Schomburg D, J Mol Biol. 1999 Oct 29;293(3):595-611. PMID:[http://ispc.weizmann.ac.il//pmbin/getpm?pmid=10543953 10543953]
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X-ray structure determination of a vanadium-dependent haloperoxidase from Ascophyllum nodosum at 2.0 A resolution., Weyand M, Hecht H, Kiess M, Liaud M, Vilter H, Schomburg D, J Mol Biol. 1999 Oct 29;293(3):595-611. PMID:[http://www.ncbi.nlm.nih.gov/pubmed/10543953 10543953]
[[Category: Ascophyllum nodosum]]
[[Category: Ascophyllum nodosum]]
[[Category: Chloride peroxidase]]
[[Category: Chloride peroxidase]]
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[[Category: vanadium]]
[[Category: vanadium]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 14:39:52 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Mar 20 13:37:55 2008''

Revision as of 11:37, 20 March 2008


PDB ID 1qi9

Drag the structure with the mouse to rotate
, resolution 2.05Å
Ligands: and
Activity: Chloride peroxidase, with EC number 1.11.1.10
Coordinates: save as pdb, mmCIF, xml



X-RAY SIRAS STRUCTURE DETERMINATION OF A VANADIUM-DEPENDENT HALOPEROXIDASE FROM ASCOPHYLLUM NODOSUM AT 2.0 A RESOLUTION


Overview

The homo-dimeric structure of a vanadium-dependent haloperoxidase (V-BPO) from the brown alga Ascophyllum nodosum (EC 1.1.11.X) has been solved by single isomorphous replacement anomalous scattering (SIRAS) X-ray crystallography at 2.0 A resolution (PDB accession code 1QI9), using two heavy-atom datasets of a tungstate derivative measured at two different wavelengths. The protein sequence (SwissProt entry code P81701) of V-BPO was established by combining results from protein and DNA sequencing, and electron density interpretation. The enzyme has nearly an all-helical structure, with two four-helix bundles and only three small beta-sheets. The holoenzyme contains trigonal-bipyramidal coordinated vanadium atoms at its two active centres. Structural similarity to the only other structurally characterized vanadium-dependent chloroperoxidase (V-CPO) from Curvularia inaequalis exists in the vicinity of the active site and to a lesser extent in the central four-helix bundle. Despite the low sequence and structural similarity between V-BPO and V-CPO, the vanadium binding centres are highly conserved on the N-terminal side of an alpha-helix and include the proposed catalytic histidine residue (His418(V-BPO)/His404(V-CPO)). The V-BPO structure contains, in addition, a second histidine near the active site (His411(V-BPO)), which can alter the redox potential of the catalytically active VO2-O2 species by protonation/deprotonation reactions. Specific binding sites for the organic substrates, like indoles and monochlordimedone, or for halide ions are not visible in the V-BPO structure. A reaction mechanism for the enzymatic oxidation of halides is discussed, based on the present structural, spectroscopic and biochemical knowledge of vanadium-dependent haloperoxidases, explaining the observed enzymatic differences between both enzymes.

About this Structure

1QI9 is a Single protein structure of sequence from Ascophyllum nodosum. Full crystallographic information is available from OCA.

Reference

X-ray structure determination of a vanadium-dependent haloperoxidase from Ascophyllum nodosum at 2.0 A resolution., Weyand M, Hecht H, Kiess M, Liaud M, Vilter H, Schomburg D, J Mol Biol. 1999 Oct 29;293(3):595-611. PMID:10543953

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