{"id":1564,"date":"2017-04-12T08:59:44","date_gmt":"2017-04-12T06:59:44","guid":{"rendered":"https:\/\/wissen.science-and-fun.de\/chemistry\/?p=1564"},"modified":"2017-04-28T20:43:24","modified_gmt":"2017-04-28T18:43:24","slug":"threonine-thr-t","status":"publish","type":"post","link":"https:\/\/wissen.science-and-fun.de\/chemistry\/2017\/04\/12\/threonine-thr-t\/","title":{"rendered":"Threonine (Thr, T)"},"content":{"rendered":"<h3>NMR- data [1] of threonine:<\/h3>\n<table border=\"1\">\n<tbody>\n<tr>\n<th rowspan=\"12\"><img data-recalc-dims=\"1\" loading=\"lazy\" decoding=\"async\" class=\"alignleft size-full wp-image-6141\" src=\"https:\/\/i0.wp.com\/wissen.science-and-fun.de\/wp-content\/uploads\/2014\/02\/threonin.png?resize=198%2C138&#038;ssl=1\" alt=\"Threonin\" width=\"198\" height=\"138\" \/><\/th>\n<th rowspan=\"2\" valign=\"top\">Atom<\/th>\n<th rowspan=\"2\" valign=\"top\">Atomtyp<\/th>\n<th colspan=\"3\">chemical shift [ppm]<sup>1<\/sup><\/th>\n<th rowspan=\"2\">Random Coil<br \/>\nchem. shift<sup>3<\/sup><\/th>\n<th rowspan=\"2\">Random Coil<br \/>\nchem. shift <sup>4<\/sup><\/th>\n<\/tr>\n<tr>\n<td><strong>average<\/strong><\/td>\n<td><strong>standard deviation<\/strong><\/td>\n<td><strong>entrie<sup>2<\/sup><\/strong><\/td>\n<\/tr>\n<tr>\n<td>H<\/td>\n<td>H<\/td>\n<td>\u00a08.244<\/td>\n<td>1.139<\/td>\n<td>44831<\/td>\n<td>\u00a08.15<\/td>\n<td>\u00a08.15<\/td>\n<\/tr>\n<tr>\n<td>H\u03b1<\/td>\n<td>H<\/td>\n<td>\u00a04.458<\/td>\n<td>0.556<\/td>\n<td>34443<\/td>\n<td>\u00a04.35<\/td>\n<td>\u00a04.61<\/td>\n<\/tr>\n<tr>\n<td>H\u03b2<\/td>\n<td>H<\/td>\n<td>\u00a04.172<\/td>\n<td>0.837<\/td>\n<td>31798<\/td>\n<td>\u00a04.24<\/td>\n<td>\u00a04.11<\/td>\n<\/tr>\n<tr>\n<td>H\u03b31<\/td>\n<td>H<\/td>\n<td>\u00a05.311<\/td>\n<td>1.322<\/td>\n<td>1227<\/td>\n<td>\u00a0&#8211;<\/td>\n<td>\u00a0&#8211;<\/td>\n<\/tr>\n<tr>\n<td>H\u03b32<\/td>\n<td>H<\/td>\n<td>\u00a01.139<\/td>\n<td>0.331<\/td>\n<td>31493<\/td>\n<td>\u00a01.21<\/td>\n<td>\u00a01.23<\/td>\n<\/tr>\n<tr>\n<td>C<\/td>\n<td>C<\/td>\n<td>\u00a0174.464<\/td>\n<td>4.246<\/td>\n<td>27922<\/td>\n<td>\u00a0174.7<\/td>\n<td>\u00a0173.2<\/td>\n<\/tr>\n<tr>\n<td>C\u03b1<\/td>\n<td>C<\/td>\n<td>\u00a062.245<\/td>\n<td>2.658<\/td>\n<td>38914<\/td>\n<td>\u00a061.8<\/td>\n<td>\u00a059.8<\/td>\n<\/tr>\n<tr>\n<td>C\u03b2<\/td>\n<td>C<\/td>\n<td>\u00a069.599<\/td>\n<td>6.601<\/td>\n<td>36242<\/td>\n<td>\u00a069.8<\/td>\n<td>\u00a069.8<\/td>\n<\/tr>\n<tr>\n<td>C\u03b32<\/td>\n<td>C<\/td>\n<td>\u00a021.591<\/td>\n<td>1.984<\/td>\n<td>25736<\/td>\n<td>\u00a021.5<\/td>\n<td>\u00a021.4<\/td>\n<\/tr>\n<tr>\n<td>N<\/td>\n<td>N<\/td>\n<td>\u00a0115.489<\/td>\n<td>6.833<\/td>\n<td>41840<\/td>\n<td>\u00a0113.6<\/td>\n<td>\u00a0116.0<\/td>\n<\/tr>\n<tr>\n<th>proportion in proteins<\/th>\n<th colspan=\"2\">pK<sub>2<\/sub> COOH<\/th>\n<th>pK<sub>1<\/sub>COOH<\/th>\n<th colspan=\"2\">isoelectrical<br \/>\npoint<\/th>\n<th>pK<sub>1<\/sub>NH<sub>2<\/sub><\/th>\n<th>pK<sub>2<\/sub>NH<sub>2<\/sub><\/th>\n<\/tr>\n<tr>\n<td>\u00a06.0%<\/td>\n<td colspan=\"2\">\u00a0&#8211;<\/td>\n<td>\u00a02.1<\/td>\n<td colspan=\"2\">\u00a05.6<\/td>\n<td>\u00a09.12<\/td>\n<td>\u00a0&#8211;<\/td>\n<\/tr>\n<tr>\n<th>CAS- number<\/th>\n<th colspan=\"2\">molar mass<\/th>\n<th>formula<\/th>\n<th colspan=\"2\">density<\/th>\n<th>melting point<\/th>\n<th>solubility<\/th>\n<\/tr>\n<tr>\n<td>\n<ul>\n<li>72-19-5 (<small>L<\/small>-Threonine)<\/li>\n<li>632-20-2 (<small>D<\/small>-Threonine)<\/li>\n<li>80-68-2 (<small>DL<\/small>-Threonine)<\/li>\n<li>28954-12-3 (<small>L<\/small>&#8211;<i>allo<\/i>-Threonine)<\/li>\n<li>24830-94-2 (<small>D<\/small>&#8211;<i>allo<\/i>-Threonine)<\/li>\n<\/ul>\n<\/td>\n<td colspan=\"2\">\u00a0119,12\u00a0<a title=\"Gramm\" href=\"http:\/\/de.wikipedia.org\/wiki\/Gramm\">g<\/a>\u00b7mol<sup>\u22121<\/sup><\/td>\n<td>\u00a0C<sub>4<\/sub>H<sub>9<\/sub>NO<sub>3<\/sub><\/td>\n<td colspan=\"2\"><\/td>\n<td>\u00a0255\u2013257\u00a0\u00b0C\u00a0(<i>decomposition<\/i>)(<small>L<\/small>-Threonine)<\/td>\n<td>\u00a0not good in\u00a0water (90 g\u00b7l<sup>\u22121<\/sup>\u00a0at 20 \u00b0C), unsoluble in organic solvents<sup id=\"cite_ref-5\"><a href=\"http:\/\/de.wikipedia.org\/wiki\/Threonin#cite_note-5\"><br \/>\n<\/a><\/sup><\/td>\n<\/tr>\n<\/tbody>\n<\/table>\n<hr \/>\n<p><sup>1<\/sup> Depending on the type of atom it was <sup>1<\/sup>H, <sup>13<\/sup>C or <sup>15<\/sup>N chemical shift. <sup>1<\/sup>H und <sup>13<\/sup>C relative to TMS and <sup>15<\/sup>N relative to liquid ammonia<\/p>\n<p><sup>2<\/sup> Number of individual chemical shift data for averaging according to [2]<\/p>\n<p><sup>3<\/sup> with Alanine as neighborhood in the hexapeptide Gly-Gly-X-Ala-Gly-Gly [3]<\/p>\n<p><sup>4<\/sup> with Proline as neighborhood in the hexapeptide Gly-Gly-X-Pro-Gly-Gly [3]<\/p>\n<hr>\n<h3>3D- Modell<\/h3>\n<div style=\"height: 400px; width: 400px; border-style: solid; position: relative;\" class='viewer_3Dmoljs' data-href='https:\/\/wissen.science-and-fun.de\/molekel\/threonin.sdf' data-backgroundcolor='0xffffff' data-style='stick' data-typ='sdf'><\/div>\n<p><\/p>\n<p>sources:<\/p>\n<p>[1] &#8220;BioMagResBank&#8221;, Eldon L. Ulrich; Hideo Akutsu; Jurgen F. Doreleijers; Yoko Harano; Yannis E. Ioannidis; Jundong Lin; Miron Livny; Steve Mading; Dimitri Maziuk; Zachary Miller; Eiichi Nakatani; Christopher F. Schulte; David E. Tolmie; R. Kent Wenger; Hongyang Yao; John L. Markley; Nucleic Acids Research 36, D402-D408 (2008) doi: 10.1093\/nar\/gkm957<\/p>\n<p>[2] http:\/\/www.bmrb.wisc.edu\/ last visit march 2017<\/p>\n<p>[3] David S. Wishart, Colin G. Bigam, Arne Holm, Robert S. Hodges, Brian D. Sykes; Journal of Biomolecular NMR<br \/>\nJanuary 1995, Volume 5, Issue 1, pp 67-81 doi:10.1007\/BF00227471<\/p>\n<p>[4] Wikipedia\u00a0http:\/\/de.wikipedia.org\/wiki\/Aminos%C3%A4uren (last visit january 2014)<\/p>\n<p>[5] Wikipedia http:\/\/de.wikipedia.org\/wiki\/Alanin\u00a0(las visit Januar 2014)proportion of proteinsproportion of proteins<\/p>\n<p>3D Mol: Nicholas Rego and David Koes<br \/>\n3Dmol.js: molecular visualization with WebGL<br \/>\nBioinformatics (2015) 31 (8): 1322-1324 doi:10.1093\/bioinformatics\/btu829<\/p>\n","protected":false},"excerpt":{"rendered":"<p>NMR- data [1] of threonine: Atom Atomtyp chemical shift [ppm]1 Random Coil chem. shift3 Random Coil chem. shift 4 average standard deviation entrie2 H H \u00a08.244 1.139 44831 \u00a08.15 \u00a08.15 H\u03b1 H \u00a04.458 0.556 34443 \u00a04.35 \u00a04.61 H\u03b2 H \u00a04.172 0.837 31798 \u00a04.24 \u00a04.11 H\u03b31 H \u00a05.311 1.322 1227 \u00a0&#8211; \u00a0&#8211; H\u03b32 H \u00a01.139 0.331 &hellip; <\/p>\n<p><a class=\"more-link btn\" href=\"https:\/\/wissen.science-and-fun.de\/chemistry\/2017\/04\/12\/threonine-thr-t\/\">Continue reading<\/a><\/p>\n","protected":false},"author":1,"featured_media":0,"comment_status":"open","ping_status":"open","sticky":false,"template":"","format":"standard","meta":{"wprm-recipe-roundup-name":"","wprm-recipe-roundup-description":"","jetpack_post_was_ever_published":false,"_jetpack_newsletter_access":"","_jetpack_dont_email_post_to_subs":false,"_jetpack_newsletter_tier_id":0,"_jetpack_memberships_contains_paywalled_content":false,"_jetpack_memberships_contains_paid_content":false,"footnotes":"","jetpack_publicize_message":"","jetpack_publicize_feature_enabled":true,"jetpack_social_post_already_shared":true,"jetpack_social_options":{"image_generator_settings":{"template":"highway","default_image_id":0,"font":"","enabled":false},"version":2}},"categories":[5,4],"tags":[98,99,115],"class_list":["post-1564","post","type-post","status-publish","format-standard","hentry","category-nmr","category-spectroscopy","tag-bio-nmr","tag-nmr","tag-threonine","item-wrap"],"yoast_head":"<!-- This site is optimized with the Yoast SEO plugin v27.4 - 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