Structural changes in retinol binding protein induced by retinol removal. A molecular dynamics study
Relationships between structure and function for retinol binding protein (RBP) are elucidated with help of a 2.0 Å resolution X-ray structure of the holo-protein and an average molecular dynamics (MD structure of the apo-form. Comparisons between MD simulations of bot the apo- and holo-forms with th...
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| Veröffentlicht in: | Biochemical and biophysical research communications 1986-09, Vol.139 (2), p.564-570 |
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| container_end_page | 570 |
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| container_issue | 2 |
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| container_title | Biochemical and biophysical research communications |
| container_volume | 139 |
| creator | Sandblom, P. Åqvist, J. Jones, T.A. Newcomer, M.E. van Gunsteren, W.F. Tapia, O. |
| description | Relationships between structure and function for retinol binding protein (RBP) are elucidated with help of a 2.0 Å resolution X-ray structure of the holo-protein and an average molecular dynamics (MD structure of the apo-form. Comparisons between MD simulations of bot the apo- and holo-forms with the X-ray holo-structure show conformational changes in apo-RBP that may be functionally significant. The average three dimensional structure obtained for apo-RBP is compared to the related protein apo-
β-lactoglobulin. Available biochemical information is consistent with structure/function relationships derived here. |
| doi_str_mv | 10.1016/S0006-291X(86)80028-6 |
| format | Article |
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β-lactoglobulin. Available biochemical information is consistent with structure/function relationships derived here.</description><subject>Applied sciences</subject><subject>Exact sciences and technology</subject><subject>Humans</subject><subject>Models, Molecular</subject><subject>Other techniques and industries</subject><subject>Protein Conformation</subject><subject>Retinol-Binding Proteins - analysis</subject><subject>Stereoisomerism</subject><subject>Structure-Activity Relationship</subject><subject>Vitamin A - physiology</subject><subject>X-Ray Diffraction</subject><issn>0006-291X</issn><issn>1090-2104</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>1986</creationdate><recordtype>article</recordtype><sourceid>EIF</sourceid><recordid>eNqFkEtr3DAQgEVpSbZpf0JAh1DSg9OR5ZWlUwihLwj0kAR6E_JonCjIciLZgf339WaXvfY0zMw3Dz7GTgVcCBDq2y0AqKo24u-5Vl81QK0r9Y6tBBioagHNe7Y6IMfsYylPAEI0yhyxI9mq1rR6xfztlGec5uwix0eXHqjwkHimKaQx8i4kH9IDf87jREt9SWckz7vNAck0jK8uXvArPoyRcI4uc79JbghYeJlmv_nEPvQuFvq8jyfs_sf3u-tf1c2fn7-vr24qlNpMVa2k022nUXWyIe_qDtYelDFeG0c9GeWcaOvGqx6xQ5Syb3q91uB7bVqP8oR92e1d3n2ZqUx2CAUpRpdonIttWzCykWoB1zsQ81hKpt4-5zC4vLEC7NaufbNrt-qsVvbNrt3One4PzN1A_jC117n0z_Z9V9DFPruEoRwwLRsD9XrBLncYLTJeA2VbMFBaxIZMOFk_hv888g_WzJkb</recordid><startdate>19860914</startdate><enddate>19860914</enddate><creator>Sandblom, P.</creator><creator>Åqvist, J.</creator><creator>Jones, T.A.</creator><creator>Newcomer, M.E.</creator><creator>van Gunsteren, W.F.</creator><creator>Tapia, O.</creator><general>Elsevier Inc</general><general>Elsevier</general><scope>IQODW</scope><scope>CGR</scope><scope>CUY</scope><scope>CVF</scope><scope>ECM</scope><scope>EIF</scope><scope>NPM</scope><scope>AAYXX</scope><scope>CITATION</scope><scope>7X8</scope></search><sort><creationdate>19860914</creationdate><title>Structural changes in retinol binding protein induced by retinol removal. A molecular dynamics study</title><author>Sandblom, P. ; Åqvist, J. ; Jones, T.A. ; Newcomer, M.E. ; van Gunsteren, W.F. ; Tapia, O.</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c389t-263a87b8c6b34eda2b05d0699d89aefe96aa1724d6fccbcc33f4f8580df897dc3</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>1986</creationdate><topic>Applied sciences</topic><topic>Exact sciences and technology</topic><topic>Humans</topic><topic>Models, Molecular</topic><topic>Other techniques and industries</topic><topic>Protein Conformation</topic><topic>Retinol-Binding Proteins - analysis</topic><topic>Stereoisomerism</topic><topic>Structure-Activity Relationship</topic><topic>Vitamin A - physiology</topic><topic>X-Ray Diffraction</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Sandblom, P.</creatorcontrib><creatorcontrib>Åqvist, J.</creatorcontrib><creatorcontrib>Jones, T.A.</creatorcontrib><creatorcontrib>Newcomer, M.E.</creatorcontrib><creatorcontrib>van Gunsteren, W.F.</creatorcontrib><creatorcontrib>Tapia, O.</creatorcontrib><collection>Pascal-Francis</collection><collection>Medline</collection><collection>MEDLINE</collection><collection>MEDLINE (Ovid)</collection><collection>MEDLINE</collection><collection>MEDLINE</collection><collection>PubMed</collection><collection>CrossRef</collection><collection>MEDLINE - Academic</collection><jtitle>Biochemical and biophysical research communications</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Sandblom, P.</au><au>Åqvist, J.</au><au>Jones, T.A.</au><au>Newcomer, M.E.</au><au>van Gunsteren, W.F.</au><au>Tapia, O.</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Structural changes in retinol binding protein induced by retinol removal. A molecular dynamics study</atitle><jtitle>Biochemical and biophysical research communications</jtitle><addtitle>Biochem Biophys Res Commun</addtitle><date>1986-09-14</date><risdate>1986</risdate><volume>139</volume><issue>2</issue><spage>564</spage><epage>570</epage><pages>564-570</pages><issn>0006-291X</issn><eissn>1090-2104</eissn><coden>BBRCA9</coden><abstract>Relationships between structure and function for retinol binding protein (RBP) are elucidated with help of a 2.0 Å resolution X-ray structure of the holo-protein and an average molecular dynamics (MD structure of the apo-form. Comparisons between MD simulations of bot the apo- and holo-forms with the X-ray holo-structure show conformational changes in apo-RBP that may be functionally significant. The average three dimensional structure obtained for apo-RBP is compared to the related protein apo-
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| ispartof | Biochemical and biophysical research communications, 1986-09, Vol.139 (2), p.564-570 |
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| language | eng |
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| source | MEDLINE; ScienceDirect Journals (5 years ago - present) |
| subjects | Applied sciences Exact sciences and technology Humans Models, Molecular Other techniques and industries Protein Conformation Retinol-Binding Proteins - analysis Stereoisomerism Structure-Activity Relationship Vitamin A - physiology X-Ray Diffraction |
| title | Structural changes in retinol binding protein induced by retinol removal. A molecular dynamics study |
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