4m3d: Difference between revisions

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

~~The entry~~ 4m3d is ~~ON HOLD~~

==Rapid and efficient design of new inhibitors of Mycobacterium tuberculosis transcriptional repressor EthR using fragment growing, merging and linking approaches==

== Structural highlights ==

<table><tr><td colspan='2'>[[4m3d]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Mycobacterium_tuberculosis_H37Rv Mycobacterium tuberculosis H37Rv]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4M3D OCA]. For a guided tour on the structure components use [https://proteopedia.org/fgij/fg.htm?mol=4M3D FirstGlance].

</td></tr><tr id='method'><td class="sblockLbl">[[Empirical_models|Method:]]</td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 1.9Å</td></tr>

<tr id='ligand'><td class="sblockLbl">[[Ligand|Ligands:]]</td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=2H2:4-{3-[(PHENYLSULFONYL)AMINO]PROP-1-YN-1-YL}-N-(3,3,3-TRIFLUOROPROPYL)BENZAMIDE'>2H2</scene></td></tr>

<tr id='resources'><td class="sblockLbl">Resources:</td><td class="sblockDat">[https://proteopedia.org/fgij/fg.htm?mol=4m3d FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4m3d OCA], [https://pdbe.org/4m3d PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4m3d RCSB], [https://www.ebi.ac.uk/pdbsum/4m3d PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4m3d ProSAT]</td></tr>

</table>

== Function ==

[https://www.uniprot.org/uniprot/ETHR_MYCTU ETHR_MYCTU] Involved in the repression of the monooxygenase EthA which is responsible of the formation of the active metabolite of ethionamide (ETH).<ref>PMID:10869356</ref> <ref>PMID:10944230</ref>

~~Authors~~: ~~Villemagne, B., Flipo, M.,~~ Blondiaux, N., Crauste, C., Malaquin, S~~., Leroux, F.,~~ Piveteau, C., Villeret, V~~., Brodin, P.,~~ Villoutreix, B~~., Sperandio, O., Wohlkonig, A., Wintjens, R., Deprez, B., Baulard, A.,~~ Willand, N.

==See Also==

*[[Tetracycline repressor protein 3D structures|Tetracycline repressor protein 3D structures]]

~~Description~~: ~~Rapid and efficient design of new inhibitors of Mycobacterium tuberculosis transcriptional repressor EthR using fragment growing, merging and linking approaches~~

== References ==

__TOC__

</StructureSection>

[[Category: Large Structures]]

[[Category: Mycobacterium tuberculosis H37Rv]]

[[Category: Baulard A]]

[[Category: Blondiaux N]]

[[Category: Brodin P]]

[[Category: Crauste C]]

[[Category: Deprez B]]

[[Category: Flipo M]]

[[Category: Leroux F]]

[[Category: Malaquin S]]

[[Category: Piveteau C]]

[[Category: Sperandio O]]

[[Category: Villemagne B]]

[[Category: Villeret V]]

[[Category: Villoutreix B]]

[[Category: Willand N]]

[[Category: Wintjens R]]

[[Category: Wohlkonig A]]

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@@ Line 1: / Line 1: @@
-'''Unreleased structure'''
-The entry 4m3d is ON HOLD
+==Rapid and efficient design of new inhibitors of Mycobacterium tuberculosis transcriptional repressor EthR using fragment growing, merging and linking approaches==
+<StructureSection load='4m3d' size='340' side='right'caption='[[4m3d]], [[Resolution|resolution]] 1.90&Aring;' scene=''>
+== Structural highlights ==
+<table><tr><td colspan='2'>[[4m3d]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Mycobacterium_tuberculosis_H37Rv Mycobacterium tuberculosis H37Rv]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=4M3D OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=4M3D 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]] 1.9&#8491;</td></tr>
+<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=2H2:4-{3-[(PHENYLSULFONYL)AMINO]PROP-1-YN-1-YL}-N-(3,3,3-TRIFLUOROPROPYL)BENZAMIDE'>2H2</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=4m3d FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=4m3d OCA], [https://pdbe.org/4m3d PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=4m3d RCSB], [https://www.ebi.ac.uk/pdbsum/4m3d PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=4m3d ProSAT]</span></td></tr>
+</table>
+== Function ==
+[https://www.uniprot.org/uniprot/ETHR_MYCTU ETHR_MYCTU] Involved in the repression of the monooxygenase EthA which is responsible of the formation of the active metabolite of ethionamide (ETH).<ref>PMID:10869356</ref> <ref>PMID:10944230</ref>
-Authors: Villemagne, B., Flipo, M., Blondiaux, N., Crauste, C., Malaquin, S., Leroux, F., Piveteau, C., Villeret, V., Brodin, P., Villoutreix, B., Sperandio, O., Wohlkonig, A., Wintjens, R., Deprez, B., Baulard, A., Willand, N.
+==See Also==
+*[[Tetracycline repressor protein 3D structures|Tetracycline repressor protein 3D structures]]
-Description: Rapid and efficient design of new inhibitors of Mycobacterium tuberculosis transcriptional repressor EthR using fragment growing, merging and linking approaches
+== References ==
+<references/>
+__TOC__
+</StructureSection>
+[[Category: Large Structures]]
+[[Category: Mycobacterium tuberculosis H37Rv]]
+[[Category: Baulard A]]
+[[Category: Blondiaux N]]
+[[Category: Brodin P]]
+[[Category: Crauste C]]
+[[Category: Deprez B]]
+[[Category: Flipo M]]
+[[Category: Leroux F]]
+[[Category: Malaquin S]]
+[[Category: Piveteau C]]
+[[Category: Sperandio O]]
+[[Category: Villemagne B]]
+[[Category: Villeret V]]
+[[Category: Villoutreix B]]
+[[Category: Willand N]]
+[[Category: Wintjens R]]
+[[Category: Wohlkonig A]]