View source for 7g7m


==Crystal Structure of rat Autotaxin in complex with N-[(3,4-dichlorophenyl)methyl]-N-methyl-2-[4-oxo-6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]quinazolin-3-yl]acetamide, i.e. SMILES N1=C(SC=C1)N1CCN(CC1)c1ccc2N=CN(CC(=O)N(C)Cc3ccc(c(c3)Cl)Cl)C(=O)c2c1 with IC50=0.0764342 microM==
<StructureSection load='7g7m' size='340' side='right'caption='[[7g7m]], [[Resolution|resolution]] 1.69&Aring;' scene=''>
== Structural highlights ==
<table><tr><td colspan='2'>[[7g7m]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Rattus_norvegicus Rattus norvegicus]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=7G7M OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=7G7M FirstGlance]. <br>
</td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 1.69&#8491;</td></tr>
<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=ACT:ACETATE+ION'>ACT</scene>, <scene name='pdbligand=BMA:BETA-D-MANNOSE'>BMA</scene>, <scene name='pdbligand=CA:CALCIUM+ION'>CA</scene>, <scene name='pdbligand=CL:CHLORIDE+ION'>CL</scene>, <scene name='pdbligand=MAN:ALPHA-D-MANNOSE'>MAN</scene>, <scene name='pdbligand=NA:SODIUM+ION'>NA</scene>, <scene name='pdbligand=NAG:N-ACETYL-D-GLUCOSAMINE'>NAG</scene>, <scene name='pdbligand=XW6:~{N}-[(3,4-dichlorophenyl)methyl]-~{N}-methyl-2-[4-oxidanylidene-6-[4-(1,3-thiazol-2-yl)piperazin-1-yl]quinazolin-3-yl]ethanamide'>XW6</scene>, <scene name='pdbligand=ZN:ZINC+ION'>ZN</scene></td></tr>
<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=7g7m FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=7g7m OCA], [https://pdbe.org/7g7m PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=7g7m RCSB], [https://www.ebi.ac.uk/pdbsum/7g7m PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=7g7m ProSAT]</span></td></tr>
</table>
== Function ==
[https://www.uniprot.org/uniprot/ENPP2_RAT ENPP2_RAT] 
__TOC__
</StructureSection>
[[Category: Large Structures]]
[[Category: Rattus norvegicus]]
[[Category: Benz J]]
[[Category: Hunziker D]]
[[Category: Martin-Rainer E]]
[[Category: Rudolph MG]]
[[Category: Stihle M]]