1xoe: Difference between revisions
New page: left|200px<br /><applet load="1xoe" size="450" color="white" frame="true" align="right" spinBox="true" caption="1xoe, resolution 2.20Å" /> '''N9 Tern influenza ne... |
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[[Image:1xoe.gif|left|200px]]<br /><applet load="1xoe" size=" | [[Image:1xoe.gif|left|200px]]<br /><applet load="1xoe" size="350" color="white" frame="true" align="right" spinBox="true" | ||
caption="1xoe, resolution 2.20Å" /> | caption="1xoe, resolution 2.20Å" /> | ||
'''N9 Tern influenza neuraminidase complexed with (2R,4R,5R)-5-(1-Acetylamino-3-methyl-butyl-pyrrolidine-2, 4-dicarobyxylic acid 4-methyl esterdase complexed with'''<br /> | '''N9 Tern influenza neuraminidase complexed with (2R,4R,5R)-5-(1-Acetylamino-3-methyl-butyl-pyrrolidine-2, 4-dicarobyxylic acid 4-methyl esterdase complexed with'''<br /> | ||
==Overview== | ==Overview== | ||
(+/-)-(2R,3R,5R)-[2-(1'-S-acetamido-3'-methyl)butyl-3-methoxycarbonyl]tetr | (+/-)-(2R,3R,5R)-[2-(1'-S-acetamido-3'-methyl)butyl-3-methoxycarbonyl]tetr ahydrofuran-5-carboxylic acid (9) and (+/-)-(2R,3R,5R)-[2-(1'-S-acetamido-3'-methyl)butyl-3-(4'-imidazolyl)]tetr ahydrofuran 5-carboxylic acid (14) were synthesized as inhibitors of influenza neuraminidase (NA). Both compounds 9 and 14 inhibit influenza NA A with an IC(50) of about 0.5 microM and NA B with an IC(50) of 1.0 microM. | ||
==About this Structure== | ==About this Structure== | ||
1XOE is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Influenza_a_virus Influenza a virus] with MAN, NAG and ABX as [http://en.wikipedia.org/wiki/ligands ligands]. Active as [http://en.wikipedia.org/wiki/Exo-alpha-sialidase Exo-alpha-sialidase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=3.2.1.18 3.2.1.18] Full crystallographic information is available from [http:// | 1XOE is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Influenza_a_virus Influenza a virus] with <scene name='pdbligand=MAN:'>MAN</scene>, <scene name='pdbligand=NAG:'>NAG</scene> and <scene name='pdbligand=ABX:'>ABX</scene> as [http://en.wikipedia.org/wiki/ligands ligands]. Active as [http://en.wikipedia.org/wiki/Exo-alpha-sialidase Exo-alpha-sialidase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=3.2.1.18 3.2.1.18] Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1XOE OCA]. | ||
==Reference== | ==Reference== | ||
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[[Category: Single protein]] | [[Category: Single protein]] | ||
[[Category: Gentles, R.]] | [[Category: Gentles, R.]] | ||
[[Category: Kati, W | [[Category: Kati, W M.]] | ||
[[Category: Kempf, D | [[Category: Kempf, D J.]] | ||
[[Category: Laver, G.]] | [[Category: Laver, G.]] | ||
[[Category: Maring, C | [[Category: Maring, C J.]] | ||
[[Category: Sowin, T.]] | [[Category: Sowin, T.]] | ||
[[Category: Stewart, K | [[Category: Stewart, K D.]] | ||
[[Category: Stoll, V.]] | [[Category: Stoll, V.]] | ||
[[Category: Wang, G | [[Category: Wang, G T.]] | ||
[[Category: Wang, S.]] | [[Category: Wang, S.]] | ||
[[Category: ABX]] | [[Category: ABX]] | ||
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[[Category: pyrrolidine inhibitors]] | [[Category: pyrrolidine inhibitors]] | ||
''Page seeded by [http:// | ''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 15:56:58 2008'' | ||
