View source for 6dky


==Crystal structure of ribifolin, an orbitide from Jatropha ribifolia==
<StructureSection load='6dky' size='340' side='right'caption='[[6dky]], [[Resolution|resolution]] 1.24&Aring;' scene=''>
== Structural highlights ==
<table><tr><td colspan='2'>[[6dky]] is a 2 chain structure with sequence from [https://en.wikipedia.org/wiki/Jatropha Jatropha]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=6DKY OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=6DKY 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]] 1.239&#8491;</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=6dky FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=6dky OCA], [https://pdbe.org/6dky PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=6dky RCSB], [https://www.ebi.ac.uk/pdbsum/6dky PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=6dky ProSAT]</span></td></tr>
</table>
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== Publication Abstract from PubMed ==
Orbitides are small cyclic peptides with a diverse range of therapeutic bioactivities. They are produced by many plant species, including those of the Jatropha genus. Here, the objective was to provide new structural information on orbitides to complement the growing knowledge base on orbitide sequences and activities by focusing on three Jatropha orbitides: ribifolin (1), pohlianin C (7), and jatrophidin (12). To determine three-dimensional structures, racemic crystallography, an emerging structural technique that enables rapid crystallization of biomolecules by combining equal amounts of the two enantiomers, was used. The high-resolution structure of ribifolin (0.99 A) was elucidated from its racemate and showed it was identical to the structure crystallized from its l-enantiomer only (1.35 A). Racemic crystallography was also used to elucidate high-resolution structures of pohlianin C (1.20 A) and jatrophidin (1.03 A), for which there was difficulty forming crystals without using racemic mixtures. The structures were used to interpret membrane permeability data in PAMPA and a Caco-2 cell assay, showing they had poor permeability. Overall, the results show racemic crystallography can be used to obtain high-resolution structures of orbitides and is useful when enantiopure samples are difficult to crystallize or solution structures from NMR are of low resolution.

Synthesis, Racemic X-ray Crystallographic, and Permeability Studies of Bioactive Orbitides from Jatropha Species.,Ramalho SD, Wang CK, King GJ, Byriel KA, Huang YH, Bolzani VS, Craik DJ J Nat Prod. 2018 Oct 22. doi: 10.1021/acs.jnatprod.8b00447. PMID:30345754<ref>PMID:30345754</ref>

From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
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<div class="pdbe-citations 6dky" style="background-color:#fffaf0;"></div>
== References ==
<references/>
__TOC__
</StructureSection>
[[Category: Jatropha]]
[[Category: Large Structures]]
[[Category: Craik DJ]]
[[Category: King GJ]]
[[Category: Ramalho SD]]
[[Category: Wang CK]]