5ehl: Difference between revisions

Line 1:

~~'''Unreleased structure'''~~

~~The entry~~ 5ehl ~~is ON HOLD until Paper Publication~~

==Rapid Discovery of Pyrido[3,4-d]pyrimidine Inhibitors of Monopolar Spindle kinase 1 (MPS1) Using a Structure-Based Hydridization Approach==

~~Authors~~: ~~Innocenti, P~~.~~, Woodward, H~~.L.~~, Solanki, S~~.~~, Naud, N~~.~~, Westwood, I~~.M.~~, Cronin, N~~.~~, Hayes, A~~., ~~Roberts, J~~.~~, Henley, A~~.T.~~, Baker, R~~.~~, Faisal, A~~.~~, Mak, G~~.~~, Box, G~~.~~, Valenti, M~~.~~, De Haven Brandon, A~~.~~, O~~'~~Fee~~, L., ~~Saville~~, J.~~, Schmitt, J~~.~~, Burke, R~~., ~~van Montfort, R~~.L.M., ~~Raymaud, F~~.I., ~~Eccles~~, S.A., ~~Linardopoulos, S~~., Blagg, J~~., Hoelder, S.~~

== Structural highlights ==

<table><tr><td colspan='2'>[[5ehl]] is a 1 chain structure. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=5EHL OCA]. For a guided tour on the structure components use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=5EHL FirstGlance].

~~Description~~: ~~Rapid Discovery of Pyrido[3~~,~~4-d~~]~~pyrimidine Inhibitors of Monopolar Spindle kinase 1 (MPS1) Using a Structure-Based Hydridization Approach~~

</td></tr><tr id='ligand'><td class="sblockLbl">[[Ligand|Ligands:]]</td><td class="sblockDat"><scene name='pdbligand=0SQ:1-[3-TERT-BUTYL-1-(4-METHYLPHENYL)-1H-PYRAZOL-5-YL]UREA'>0SQ</scene></td></tr>

[[Category: ~~Unreleased Structures~~]]

<tr id='related'><td class="sblockLbl">[[Related_structure|Related:]]</td><td class="sblockDat">[[5eh0|5eh0]]</td></tr>

<tr id='activity'><td class="sblockLbl">Activity:</td><td class="sblockDat">[http://en.wikipedia.org/wiki/Dual-specificity_kinase Dual-specificity kinase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=2.7.12.1 2.7.12.1] </td></tr>

<tr id='resources'><td class="sblockLbl">Resources:</td><td class="sblockDat">[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=5ehl FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=5ehl OCA], [http://pdbe.org/5ehl PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=5ehl RCSB], [http://www.ebi.ac.uk/pdbsum/5ehl PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=5ehl ProSAT]</td></tr>

</table>

== Function ==

[[http://www.uniprot.org/uniprot/TTK_HUMAN TTK_HUMAN]] Phosphorylates proteins on serine, threonine, and tyrosine. Probably associated with cell proliferation. Essential for chromosome alignment by enhancing AURKB activity (via direct CDCA8 phosphorylation) at the centromere, and for the mitotic checkpoint.<ref>PMID:18243099</ref>

== References ==

__TOC__

</StructureSection>

[[Category: Dual-specificity kinase]]

[[Category: Baker, R]]

[[Category: Blagg, J]]

[[Category: Box, G]]

[[Category: Brandon, A De Haven]]

[[Category: Burke, R]]

[[Category: ~~Van Montfort~~, R.L.M]]

[[Category: Cronin, N]]

[[Category: ~~Woodward~~, ~~H.L~~]]

[[Category: Eccles, S A]]

[[Category: Faisal, A]]

[[Category: Fee, L O]]

[[Category: Hayes, A]]

[[Category: Henley, A T]]

[[Category: Hoelder, S]]

~~[[Category: Solanki, S]]~~

[[Category: Innocenti, P]]

[[Category: ~~Hayes~~, ~~A]]~~

[[Category: Linardopoulos, S]]

~~[[Category: Blagg, J]]~~

~~[[Category: Westwood, I.M]]~~

~~[[Category: Valenti, M~~]]

[[Category: Mak, G]]

[[Category: ~~Henley~~, A.T]]

[[Category: Montfort, R L.M van]]

[[Category: ~~Cronin~~, N]]

[[Category: Naud, N]]

[[Category: Raymaud, F.I]]

[[Category: Raymaud, F I]]

[[Category: Roberts, J]]

[[Category: Saville, J]]

~~[[Category: De Haven Brandon, A]]~~

~~[[Category: Eccles, S.A]]~~

~~[[Category: Box, G]]~~

~~[[Category: Linardopoulos, S]]~~

[[Category: Schmitt, J]]

[[Category: ~~O'Fee~~, L]]

[[Category: Solanki, S]]

[[Category: ~~Faisal~~, A]]

[[Category: Valenti, M]]

[[Category: ~~Baker~~, R]]

[[Category: Westwood, I M]]

[[Category: ~~Roberts~~, J]]

[[Category: Woodward, H L]]

[[Category: ~~Naud, N~~]]

[[Category: Transferase]]

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@@ Line 1: / Line 1: @@
-'''Unreleased structure'''
-The entry 5ehl is ON HOLD  until Paper Publication
+==Rapid Discovery of Pyrido[3,4-d]pyrimidine Inhibitors of Monopolar Spindle kinase 1 (MPS1) Using a Structure-Based Hydridization Approach==
+<StructureSection load='5ehl' size='340' side='right' caption='[[5ehl]], [[Resolution|resolution]] 2.66&Aring;' scene=''>
-Authors: Innocenti, P., Woodward, H.L., Solanki, S., Naud, N., Westwood, I.M., Cronin, N., Hayes, A., Roberts, J., Henley, A.T., Baker, R., Faisal, A., Mak, G., Box, G., Valenti, M., De Haven Brandon, A., O'Fee, L., Saville, J., Schmitt, J., Burke, R., van Montfort, R.L.M., Raymaud, F.I., Eccles, S.A., Linardopoulos, S., Blagg, J., Hoelder, S.
+== Structural highlights ==
+<table><tr><td colspan='2'>[[5ehl]] is a 1 chain structure. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=5EHL OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=5EHL FirstGlance]. <br>
-Description: Rapid Discovery of Pyrido[3,4-d]pyrimidine Inhibitors of Monopolar Spindle kinase 1 (MPS1) Using a Structure-Based Hydridization Approach
+</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=0SQ:1-[3-TERT-BUTYL-1-(4-METHYLPHENYL)-1H-PYRAZOL-5-YL]UREA'>0SQ</scene></td></tr>
-[[Category: Unreleased Structures]]
+<tr id='related'><td class="sblockLbl"><b>[[Related_structure|Related:]]</b></td><td class="sblockDat">[[5eh0|5eh0]]</td></tr>
+<tr id='activity'><td class="sblockLbl"><b>Activity:</b></td><td class="sblockDat"><span class='plainlinks'>[http://en.wikipedia.org/wiki/Dual-specificity_kinase Dual-specificity kinase], with EC number [http://www.brenda-enzymes.info/php/result_flat.php4?ecno=2.7.12.1 2.7.12.1] </span></td></tr>
+<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=5ehl FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=5ehl OCA], [http://pdbe.org/5ehl PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=5ehl RCSB], [http://www.ebi.ac.uk/pdbsum/5ehl PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=5ehl ProSAT]</span></td></tr>
+</table>
+== Function ==
+[[http://www.uniprot.org/uniprot/TTK_HUMAN TTK_HUMAN]] Phosphorylates proteins on serine, threonine, and tyrosine. Probably associated with cell proliferation. Essential for chromosome alignment by enhancing AURKB activity (via direct CDCA8 phosphorylation) at the centromere, and for the mitotic checkpoint.<ref>PMID:18243099</ref>
+== References ==
+<references/>
+__TOC__
+</StructureSection>
+[[Category: Dual-specificity kinase]]
+[[Category: Baker, R]]
+[[Category: Blagg, J]]
+[[Category: Box, G]]
+[[Category: Brandon, A De Haven]]
 [[Category: Burke, R]]
-[[Category: Van Montfort, R.L.M]]
+[[Category: Cronin, N]]
-[[Category: Woodward, H.L]]
+[[Category: Eccles, S A]]
+[[Category: Faisal, A]]
+[[Category: Fee, L O]]
+[[Category: Hayes, A]]
+[[Category: Henley, A T]]
 [[Category: Hoelder, S]]
-[[Category: Solanki, S]]
 [[Category: Innocenti, P]]
-[[Category: Hayes, A]]
+[[Category: Linardopoulos, S]]
-[[Category: Blagg, J]]
-[[Category: Westwood, I.M]]
-[[Category: Valenti, M]]
 [[Category: Mak, G]]
-[[Category: Henley, A.T]]
+[[Category: Montfort, R L.M van]]
-[[Category: Cronin, N]]
+[[Category: Naud, N]]
-[[Category: Raymaud, F.I]]
+[[Category: Raymaud, F I]]
+[[Category: Roberts, J]]
 [[Category: Saville, J]]
-[[Category: De Haven Brandon, A]]
-[[Category: Eccles, S.A]]
-[[Category: Box, G]]
-[[Category: Linardopoulos, S]]
 [[Category: Schmitt, J]]
-[[Category: O'Fee, L]]
+[[Category: Solanki, S]]
-[[Category: Faisal, A]]
+[[Category: Valenti, M]]
-[[Category: Baker, R]]
+[[Category: Westwood, I M]]
-[[Category: Roberts, J]]
+[[Category: Woodward, H L]]
-[[Category: Naud, N]]
+[[Category: Transferase]]