6x5p: Difference between revisions
From Proteopedia
Jump to navigationJump to search
New page: '''Unreleased structure''' The entry 6x5p is ON HOLD until sometime in the future Authors: Jayne, C.L., Andreani, T., Chan, T., Chelliah, M.V., Clasby, M.C., Dwyer, M., Eagen, K.A., Fri... |
No edit summary |
||
| (3 intermediate revisions by the same user not shown) | |||
| Line 1: | Line 1: | ||
The | ==Discovery of Hydroxy Pyrimidine Factor IXa Inhibitors== | ||
<StructureSection load='6x5p' size='340' side='right'caption='[[6x5p]], [[Resolution|resolution]] 2.00Å' scene=''> | |||
== Structural highlights == | |||
<table><tr><td colspan='2'>Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=6X5P OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=6X5P 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]] 1.997Å</td></tr> | |||
<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=CIT:CITRIC+ACID'>CIT</scene>, <scene name='pdbligand=GOL:GLYCEROL'>GOL</scene>, <scene name='pdbligand=UQD:3-chloro-4-{[5-hydroxy-6-(4-methylphenyl)pyrimidin-4-yl]amino}benzene-1-carboximidamide'>UQD</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=6x5p FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=6x5p OCA], [https://pdbe.org/6x5p PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=6x5p RCSB], [https://www.ebi.ac.uk/pdbsum/6x5p PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=6x5p ProSAT]</span></td></tr> | |||
</table> | |||
<div style="background-color:#fffaf0;"> | |||
== Publication Abstract from PubMed == | |||
The synthesis and structure activity relationship development of a pyrimidine series of heterocyclic Factor IXa inhibitors is described. Increased selectivity over Factor Xa inhibition was achieved through SAR expansion of the P1 element. Select compounds were evaluated in vivo to assess their plasma levels in rat. | |||
Discovery of hydroxy pyrimidine Factor IXa inhibitors.,Jayne CL, Andreani T, Chan TY, Chelliah MV, Clasby MC, Dwyer M, Eagen KA, Fried S, Greenlee WJ, Guo Z, Hawes B, Hruza A, Ingram R, Keertikar KM, Neelamkavil S, Reichert P, Xia Y, Chackalamannil S Bioorg Med Chem Lett. 2020 Aug 1;30(15):127279. doi: 10.1016/j.bmcl.2020.127279. , Epub 2020 May 23. PMID:32527459<ref>PMID:32527459</ref> | |||
From MEDLINE®/PubMed®, a database of the U.S. National Library of Medicine.<br> | |||
[[Category: | </div> | ||
[[Category: | <div class="pdbe-citations 6x5p" style="background-color:#fffaf0;"></div> | ||
[[Category: Chackalamannil | |||
[[Category: | ==See Also== | ||
[[Category: | *[[Factor IX 3D structures|Factor IX 3D structures]] | ||
[[Category: | == References == | ||
[[Category: | <references/> | ||
[[Category: | __TOC__ | ||
[[Category: | </StructureSection> | ||
[[Category: | [[Category: Large Structures]] | ||
[[Category: | [[Category: Andreani T]] | ||
[[Category: | [[Category: Chackalamannil S]] | ||
[[Category: | [[Category: Chan T]] | ||
[[Category: | [[Category: Chelliah MV]] | ||
[[Category: Jayne | [[Category: Clasby MC]] | ||
[[Category: Keertikar | [[Category: Dwyer M]] | ||
[[Category: | [[Category: Eagen KA]] | ||
[[Category: | [[Category: Fried S]] | ||
[[Category: | [[Category: Greenlee WJ]] | ||
[[Category: Guo Z]] | |||
[[Category: Hawes B]] | |||
[[Category: Hruza A]] | |||
[[Category: Ingram R]] | |||
[[Category: Jayne CL]] | |||
[[Category: Keertikar KM]] | |||
[[Category: Neelamkavil S]] | |||
[[Category: Reichert P]] | |||
[[Category: Xia Y]] | |||
Latest revision as of 05:56, 21 November 2024
Discovery of Hydroxy Pyrimidine Factor IXa Inhibitors
| ||||||||||||
