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2g79

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[[Image:2g79.gif|left|200px]]
[[Image:2g79.gif|left|200px]]
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{{Structure
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|PDB= 2g79 |SIZE=350|CAPTION= <scene name='initialview01'>2g79</scene>, resolution 1.690&Aring;
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The line below this paragraph, containing "STRUCTURE_2g79", creates the "Structure Box" on the page.
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|SITE=
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|LIGAND= <scene name='pdbligand=NA:SODIUM+ION'>NA</scene>, <scene name='pdbligand=RET:RETINAL'>RET</scene>, <scene name='pdbligand=SO4:SULFATE+ION'>SO4</scene>
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|GENE= CRABP2 ([http://www.ncbi.nlm.nih.gov/Taxonomy/Browser/wwwtax.cgi?mode=Info&srchmode=5&id=9606 Homo sapiens])
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|DOMAIN=
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{{STRUCTURE_2g79| PDB=2g79 | SCENE= }}
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|RELATEDENTRY=[[2g78|2G78]], [[2g7a|2G7A]], [[2g7b|2G7B]]
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|RESOURCES=<span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=2g79 FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2g79 OCA], [http://www.ebi.ac.uk/pdbsum/2g79 PDBsum], [http://www.rcsb.org/pdb/explore.do?structureId=2g79 RCSB]</span>
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}}
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'''Crystal Structure of the R132K:Y134F Mutant of Cellular Retinoic Acid Binding Protein Type II in Complex with All-Trans-Retinal at 1.69 Angstroms Resolution'''
'''Crystal Structure of the R132K:Y134F Mutant of Cellular Retinoic Acid Binding Protein Type II in Complex with All-Trans-Retinal at 1.69 Angstroms Resolution'''
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[[Category: Geiger, J H.]]
[[Category: Geiger, J H.]]
[[Category: Vaezeslami, S.]]
[[Category: Vaezeslami, S.]]
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[[Category: beta barrel]]
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[[Category: Beta barrel]]
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[[Category: crabpii]]
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[[Category: Crabpii]]
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[[Category: crystallography]]
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[[Category: Crystallography]]
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[[Category: high resolution]]
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[[Category: High resolution]]
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[[Category: retinal]]
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[[Category: Retinal]]
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[[Category: retinoic acid]]
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[[Category: Retinoic acid]]
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[[Category: retinoid]]
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[[Category: Retinoid]]
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[[Category: x-ray]]
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[[Category: X-ray]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Sun May 4 04:46:06 2008''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Mon Mar 31 03:12:47 2008''
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Revision as of 01:46, 4 May 2008

Template:STRUCTURE 2g79

Crystal Structure of the R132K:Y134F Mutant of Cellular Retinoic Acid Binding Protein Type II in Complex with All-Trans-Retinal at 1.69 Angstroms Resolution


Overview

Rational redesign of the binding pocket of Cellular Retinoic Acid Binding Protein II (CRABPII) has provided a mutant that can bind retinal as a protonated Schiff base, mimicking the binding observed in rhodopsin. The reengineering was accomplished through a series of choreographed manipulations to ultimately orient the reactive species (the epsilon-amino group of Lys132 and the carbonyl of retinal) in the proper geometry for imine formation. The guiding principle was to achieve the appropriate Burgi-Dunitz trajectory for the reaction to ensue. Through crystallographic analysis of protein mutants incapable of forming the requisite Schiff base, a highly ordered water molecule was identified as a key culprit in orienting retinal in a nonconstructive manner. Removal of the ordered water, along with placing reinforcing mutations to favor the desired orientation of retinal, led to a triple mutant CRABPII protein capable of nanomolar binding of retinal as a protonated Schiff base. The high-resolution crystal structure of all-trans-retinal bound to the CRABPII triple mutant (1.2 A resolution) unequivocally illustrates the imine formed between retinal and the protein.

About this Structure

2G79 is a Single protein structure of sequence from Homo sapiens. Full crystallographic information is available from OCA.

Reference

Protein design: reengineering cellular retinoic acid binding protein II into a rhodopsin protein mimic., Vasileiou C, Vaezeslami S, Crist RM, Rabago-Smith M, Geiger JH, Borhan B, J Am Chem Soc. 2007 May 16;129(19):6140-8. Epub 2007 Apr 21. PMID:17447762 Page seeded by OCA on Sun May 4 04:46:06 2008

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