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==ACETYLCHOLINE BINDING PROTEIN (ACHBP) AS TEMPLATE FOR HIERARCHICAL IN SILICO SCREENING PROCEDURES TO IDENTIFY STRUCTURALLY NOVEL LIGANDS FOR THE NICOTINIC RECEPTORS==
==Acetylcholine binding protein (AChBP) as template for hierarchical in silico screening procedures to identify structurally novel ligands for the nicotinic receptors==
<StructureSection load='2xnt' size='340' side='right' caption='[[2xnt]], [[Resolution|resolution]] 3.21&Aring;' scene=''>
<StructureSection load='2xnt' size='340' side='right'caption='[[2xnt]], [[Resolution|resolution]] 3.21&Aring;' scene=''>
== Structural highlights ==
== Structural highlights ==
<table><tr><td colspan='2'>[[2xnt]] is a 10 chain structure with sequence from [http://en.wikipedia.org/wiki/Aplca Aplca]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2XNT OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2XNT FirstGlance]. <br>
<table><tr><td colspan='2'>[[2xnt]] is a 10 chain structure with sequence from [https://en.wikipedia.org/wiki/Aplysia_californica Aplysia californica]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2XNT OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=2XNT FirstGlance]. <br>
</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=BR:BROMIDE+ION'>BR</scene>, <scene name='pdbligand=VU2:(2S)-2-[(4-CHLOROBENZYL)OXY]-2-PHENYLETHANAMINE'>VU2</scene></td></tr>
</td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 3.21&#8491;</td></tr>
<tr id='related'><td class="sblockLbl"><b>[[Related_structure|Related:]]</b></td><td class="sblockDat">[[2wn9|2wn9]], [[2w8f|2w8f]], [[2byp|2byp]], [[2c9t|2c9t]], [[2byq|2byq]], [[2w8g|2w8g]], [[2x00|2x00]], [[2uz6|2uz6]], [[2wnl|2wnl]], [[2br7|2br7]], [[2br8|2br8]], [[2byr|2byr]], [[2byn|2byn]], [[2bys|2bys]], [[2wnj|2wnj]], [[2w8e|2w8e]], [[2wzy|2wzy]], [[2wnc|2wnc]], [[2xnv|2xnv]], [[2xnu|2xnu]]</td></tr>
<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=BR:BROMIDE+ION'>BR</scene>, <scene name='pdbligand=VU2:(2S)-2-[(4-CHLOROBENZYL)OXY]-2-PHENYLETHANAMINE'>VU2</scene></td></tr>
<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2xnt FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xnt OCA], [http://pdbe.org/2xnt PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=2xnt RCSB], [http://www.ebi.ac.uk/pdbsum/2xnt PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=2xnt ProSAT]</span></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=2xnt FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2xnt OCA], [https://pdbe.org/2xnt PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=2xnt RCSB], [https://www.ebi.ac.uk/pdbsum/2xnt PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=2xnt ProSAT]</span></td></tr>
</table>
</table>
== Function ==
[https://www.uniprot.org/uniprot/Q8WSF8_APLCA Q8WSF8_APLCA]
<div style="background-color:#fffaf0;">
<div style="background-color:#fffaf0;">
== Publication Abstract from PubMed ==
== Publication Abstract from PubMed ==
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==See Also==
==See Also==
*[[Acetylcholine binding protein|Acetylcholine binding protein]]
*[[Acetylcholine binding protein 3D structures|Acetylcholine binding protein 3D structures]]
== References ==
== References ==
<references/>
<references/>
__TOC__
__TOC__
</StructureSection>
</StructureSection>
[[Category: Aplca]]
[[Category: Aplysia californica]]
[[Category: Akdemir, A]]
[[Category: Large Structures]]
[[Category: Deesch, I]]
[[Category: Akdemir A]]
[[Category: Rucktooa, P]]
[[Category: Rucktooa P]]
[[Category: Sixma, T K]]
[[Category: Sixma TK]]
[[Category: Choline-binding protein]]
[[Category: DeEsch I]]
[[Category: Cys-loop receptor]]
[[Category: Electrophysiology]]
[[Category: In-silico screening]]
[[Category: Ligand-gated ion channel]]
[[Category: Receptor]]

Latest revision as of 08:01, 23 August 2023

Acetylcholine binding protein (AChBP) as template for hierarchical in silico screening procedures to identify structurally novel ligands for the nicotinic receptors

2xnt, resolution 3.21Å

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