{"id":1538,"date":"2017-04-08T16:14:05","date_gmt":"2017-04-08T14:14:05","guid":{"rendered":"https:\/\/wissen.science-and-fun.de\/chemistry\/?p=1538"},"modified":"2017-04-29T10:47:51","modified_gmt":"2017-04-29T08:47:51","slug":"aspartic-acid-asp-d","status":"publish","type":"post","link":"https:\/\/wissen.science-and-fun.de\/chemistry\/2017\/04\/08\/aspartic-acid-asp-d\/","title":{"rendered":"Aspartic Acid (Asp, D)"},"content":{"rendered":"<h3>NMR-Data [1] of Aspartic Acid:<\/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-5974\" src=\"https:\/\/i0.wp.com\/wissen.science-and-fun.de\/wp-content\/uploads\/2014\/01\/asparaginsaeure.png?resize=163%2C123&#038;ssl=1\" alt=\"Asparagins\u00e4ure\" width=\"163\" height=\"123\" \/><\/th>\n<th rowspan=\"2\" valign=\"top\">Atom<\/th>\n<th rowspan=\"2\" valign=\"top\">Atomtyp<\/th>\n<th colspan=\"3\">chemical shift\u00a0[ppm]<sup>1<\/sup><\/th>\n<th rowspan=\"2\">Random Coil<br \/>\nchem. shift\u00a0<sup>3<\/sup><\/th>\n<th rowspan=\"2\">Random Coil<br \/>\nchem. shift\u00a0<sup>4<\/sup><\/th>\n<\/tr>\n<tr>\n<td><strong>average<\/strong><\/td>\n<td><strong>standard deviation<\/strong><\/td>\n<td><strong>entries<sup>2<\/sup><\/strong><\/td>\n<\/tr>\n<tr>\n<td>H<\/td>\n<td>H<\/td>\n<td>8.304<\/td>\n<td>\u00a00.60<\/td>\n<td>\u00a047956<\/td>\n<td>\u00a08.34<\/td>\n<td>\u00a08.31<\/td>\n<\/tr>\n<tr>\n<td>H\u03b1<\/td>\n<td>H<\/td>\n<td>4.589<\/td>\n<td>\u00a00.33<\/td>\n<td>\u00a036349<\/td>\n<td>\u00a04.64<\/td>\n<td>\u00a04.90<\/td>\n<\/tr>\n<tr>\n<td>H\u03b22<\/td>\n<td>H<\/td>\n<td>2.721<\/td>\n<td>\u00a00.561<\/td>\n<td>\u00a034073<\/td>\n<td>\u00a02.72<\/td>\n<td>\u00a02.72<\/td>\n<\/tr>\n<tr>\n<td>H\u03b23<\/td>\n<td>H<\/td>\n<td>2.67<\/td>\n<td>\u00a00.568<\/td>\n<td>\u00a032689<\/td>\n<td>\u00a02.65<\/td>\n<td>\u00a02.57<\/td>\n<\/tr>\n<tr>\n<td>H\u03b4<\/td>\n<td>H<\/td>\n<td>5.308<\/td>\n<td>\u00a03.631<\/td>\n<td>\u00a09<\/td>\n<td>\u00a0&#8211;<\/td>\n<td>\u00a0&#8211;<\/td>\n<\/tr>\n<tr>\n<td>C<\/td>\n<td>C<\/td>\n<td>176.335<\/td>\n<td>3.830<\/td>\n<td>\u00a030364<\/td>\n<td>\u00a0176.3<\/td>\n<td>\u00a0175.0<\/td>\n<\/tr>\n<tr>\n<td>C\u03b1<\/td>\n<td>C<\/td>\n<td>54.681<\/td>\n<td>\u00a02.157<\/td>\n<td>41897<\/td>\n<td>\u00a054.2<\/td>\n<td>\u00a052.2<\/td>\n<\/tr>\n<tr>\n<td>C\u03b2<\/td>\n<td>C<\/td>\n<td>40.891<\/td>\n<td>\u00a02.032<\/td>\n<td>\u00a039751<\/td>\n<td>\u00a041.1<\/td>\n<td>\u00a040.9<\/td>\n<\/tr>\n<tr>\n<td>C\u03b3<\/td>\n<td>C<\/td>\n<td>177.607<\/td>\n<td>\u00a016.577<\/td>\n<td>\u00a0727<\/td>\n<td>\u00a0180.0<\/td>\n<td>\u00a0179.9<\/td>\n<\/tr>\n<tr>\n<td>N<\/td>\n<td>N<\/td>\n<td>120.648<\/td>\n<td>\u00a04.464<\/td>\n<td>\u00a045266<\/td>\n<td>\u00a0120.4<\/td>\n<td>\u00a0121.4<\/td>\n<\/tr>\n<tr>\n<th>proportion of proteines<\/th>\n<th colspan=\"2\">pK<sub>2<\/sub> COOH<\/th>\n<th>pK<sub>1<\/sub>COOH<\/th>\n<th colspan=\"2\">isoelectrical point<\/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>\u00a05.5%<\/td>\n<td colspan=\"2\">\u00a03.65<\/td>\n<td>\u00a01.88<\/td>\n<td colspan=\"2\">\u00a02.85<\/td>\n<td>\u00a09.60<\/td>\n<td>\u00a0&#8211;<\/td>\n<\/tr>\n<tr>\n<th>CAS- Nummer<\/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>56-84-8 (<small>L<\/small>&#8211;<a title=\"Enantiomer\" href=\"http:\/\/de.wikipedia.org\/wiki\/Enantiomer\">Enantiomer<\/a>)<\/li>\n<li>1783-96-6 (<small>D<\/small>-Enantiomer)<\/li>\n<li>617-45-8 (<small>DL<\/small>-Aspartic acid)<\/li>\n<\/ul>\n<\/td>\n<td colspan=\"2\">\u00a0133,10 g\/mol<sup>-1<\/sup><\/td>\n<td>\u00a0C<sub>4<\/sub>H<sub>7<\/sub>NO<sub>4<\/sub><\/td>\n<td colspan=\"2\"><\/td>\n<td>\u00a0270\u2013271\u00a0<a title=\"Grad Celsius\" href=\"http:\/\/de.wikipedia.org\/wiki\/Grad_Celsius\">\u00b0C<\/a>\u00a0(degradation)<\/td>\n<td>\u00a0bad in water (4 g\u00b7l<sup>\u22121<\/sup>\u00a0at 20 \u00b0C)<\/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\/asparaginsaeure.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\/Asparagin\u00a0(last visit january 2014)<\/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 Aspartic Acid: Atom Atomtyp chemical shift\u00a0[ppm]1 Random Coil chem. shift\u00a03 Random Coil chem. shift\u00a04 average standard deviation entries2 H H 8.304 \u00a00.60 \u00a047956 \u00a08.34 \u00a08.31 H\u03b1 H 4.589 \u00a00.33 \u00a036349 \u00a04.64 \u00a04.90 H\u03b22 H 2.721 \u00a00.561 \u00a034073 \u00a02.72 \u00a02.72 H\u03b23 H 2.67 \u00a00.568 \u00a032689 \u00a02.65 \u00a02.57 H\u03b4 H 5.308 \u00a03.631 \u00a09 \u00a0&#8211; &hellip; <\/p>\n<p><a class=\"more-link btn\" href=\"https:\/\/wissen.science-and-fun.de\/chemistry\/2017\/04\/08\/aspartic-acid-asp-d\/\">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":[103,98,99],"class_list":["post-1538","post","type-post","status-publish","format-standard","hentry","category-nmr","category-spectroscopy","tag-aspartic-acid","tag-bio-nmr","tag-nmr","item-wrap"],"yoast_head":"<!-- This site is optimized with the Yoast SEO plugin v27.3 - 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