2c8l: Difference between revisions

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New page: left|200px<br /> <applet load="2c8l" size="450" color="white" frame="true" align="right" spinBox="true" caption="2c8l, resolution 3.10Å" /> '''CRYSTAL STRUCTURE O...
 
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[[Image:2c8l.gif|left|200px]]<br />
<applet load="2c8l" size="450" color="white" frame="true" align="right" spinBox="true"
caption="2c8l, resolution 3.10&Aring;" />
'''CRYSTAL STRUCTURE OF (SR) CALCIUM-ATPASE E2(TG) FORM'''<br />


==Overview==
==Crystal Structure of (SR) Calcium-ATPase E2(Tg) form==
We present crystal structures of the calcium-free E2 state of the, sarcoplasmic reticulum Ca2+ -ATPase, stabilized by the inhibitor, thapsigargin and the ATP analog AMPPCP. The structures allow us to, describe the ATP binding site in a modulatory mode uncoupled from the, Asp351 phosphorylation site. The Glu439 side chain interacts with AMPPCP, via an Mg2+ ion in accordance with previous Fe2+ -cleavage studies, implicating this residue in the ATPase cycle and in magnesium binding., Functional data on Ca2+ mediated activation indicate that the crystallized, state represents an initial stage of ATP modulated deprotonation of E2, preceding the binding of Ca2+ ions in the membrane from the cytoplasmic, side. We propose a mechanism of Ca2+ activation of phosphorylation leading, directly from ... [[http://ispc.weizmann.ac.il/pmbin/getpm?16710301 (full description)]]
<StructureSection load='2c8l' size='340' side='right'caption='[[2c8l]], [[Resolution|resolution]] 3.10&Aring;' scene=''>
== Structural highlights ==
<table><tr><td colspan='2'>[[2c8l]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Oryctolagus_cuniculus Oryctolagus cuniculus]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2C8L OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=2C8L FirstGlance]. <br>
</td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 3.1&#8491;</td></tr>
<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=NA:SODIUM+ION'>NA</scene>, <scene name='pdbligand=TG1:[(3S,3aR,4S,6S,6aR,7S,8S,9bS)-6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-8-[(Z)-2-methylbut-2-enoyl]oxy-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-7-yl]+octanoate'>TG1</scene></td></tr>
<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=2c8l FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2c8l OCA], [https://pdbe.org/2c8l PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=2c8l RCSB], [https://www.ebi.ac.uk/pdbsum/2c8l PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=2c8l ProSAT]</span></td></tr>
</table>
== Function ==
[https://www.uniprot.org/uniprot/AT2A1_RABIT AT2A1_RABIT] This magnesium-dependent enzyme catalyzes the hydrolysis of ATP coupled with the translocation of calcium from the cytosol to the sarcoplasmic reticulum lumen. Contributes to calcium sequestration involved in muscular excitation/contraction (By similarity).
== Evolutionary Conservation ==
[[Image:Consurf_key_small.gif|200px|right]]
Check<jmol>
  <jmolCheckbox>
    <scriptWhenChecked>; select protein; define ~consurf_to_do selected; consurf_initial_scene = true; script "/wiki/ConSurf/c8/2c8l_consurf.spt"</scriptWhenChecked>
    <scriptWhenUnchecked>script /wiki/extensions/Proteopedia/spt/initialview03.spt</scriptWhenUnchecked>
    <text>to colour the structure by Evolutionary Conservation</text>
  </jmolCheckbox>
</jmol>, as determined by [http://consurfdb.tau.ac.il/ ConSurfDB]. You may read the [[Conservation%2C_Evolutionary|explanation]] of the method and the full data available from [http://bental.tau.ac.il/new_ConSurfDB/main_output.php?pdb_ID=2c8l ConSurf].
<div style="clear:both"></div>
<div style="background-color:#fffaf0;">
== Publication Abstract from PubMed ==
We present crystal structures of the calcium-free E2 state of the sarcoplasmic reticulum Ca2+ -ATPase, stabilized by the inhibitor thapsigargin and the ATP analog AMPPCP. The structures allow us to describe the ATP binding site in a modulatory mode uncoupled from the Asp351 phosphorylation site. The Glu439 side chain interacts with AMPPCP via an Mg2+ ion in accordance with previous Fe2+ -cleavage studies implicating this residue in the ATPase cycle and in magnesium binding. Functional data on Ca2+ mediated activation indicate that the crystallized state represents an initial stage of ATP modulated deprotonation of E2, preceding the binding of Ca2+ ions in the membrane from the cytoplasmic side. We propose a mechanism of Ca2+ activation of phosphorylation leading directly from the compact E2-ATP form to the Ca2E1-ATP state. In addition, a role of Glu439 in ATP modulation of other steps of the functional cycle is suggested.


==About this Structure==
Modulatory and catalytic modes of ATP binding by the calcium pump.,Jensen AM, Sorensen TL, Olesen C, Moller JV, Nissen P EMBO J. 2006 Jun 7;25(11):2305-14. Epub 2006 May 18. PMID:16710301<ref>PMID:16710301</ref>
2C8L is a [[http://en.wikipedia.org/wiki/Single_protein Single protein]] structure of sequence from [[http://en.wikipedia.org/wiki/Oryctolagus_cuniculus Oryctolagus cuniculus]] with NA and TG1 as [[http://en.wikipedia.org/wiki/ligands ligands]]. Active as [[http://en.wikipedia.org/wiki/ ]], with EC number [[http://www.brenda-enzymes.info/php/result_flat.php4?ecno=3.6.3.8 3.6.3.8]]. Full crystallographic information is available from [[http://ispc.weizmann.ac.il/oca-bin/ocashort?id=2C8L OCA]].


==Reference==
From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
Modulatory and catalytic modes of ATP binding by the calcium pump., Jensen AM, Sorensen TL, Olesen C, Moller JV, Nissen P, EMBO J. 2006 Jun 7;25(11):2305-14. Epub 2006 May 18. PMID:[http://ispc.weizmann.ac.il//pmbin/getpm?pmid=16710301 16710301]
</div>
<div class="pdbe-citations 2c8l" style="background-color:#fffaf0;"></div>
 
==See Also==
*[[ATPase 3D structures|ATPase 3D structures]]
== References ==
<references/>
__TOC__
</StructureSection>
[[Category: Large Structures]]
[[Category: Oryctolagus cuniculus]]
[[Category: Oryctolagus cuniculus]]
[[Category: Single protein]]
[[Category: Jensen AM]]
[[Category: Jensen, A.M.]]
[[Category: Moller JV]]
[[Category: Moller, J.V.]]
[[Category: Nissen P]]
[[Category: Nissen, P.]]
[[Category: Olesen C]]
[[Category: Olesen, C.]]
[[Category: Sorensen TL]]
[[Category: Sorensen, T.L.]]
[[Category: NA]]
[[Category: TG1]]
[[Category: atp-binding]]
[[Category: ca2+-atpase]]
[[Category: calcium transport]]
[[Category: cation pump]]
[[Category: hydrolase]]
[[Category: ion transport]]
[[Category: membrane protein]]
[[Category: metal-binding]]
[[Category: modulatory atp]]
[[Category: nucleotide-binding]]
[[Category: p-type atpase]]
[[Category: phosphorylation]]
 
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Latest revision as of 00:49, 21 November 2024

Crystal Structure of (SR) Calcium-ATPase E2(Tg) form

2c8l, resolution 3.10Å

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