3sfi

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{{STRUCTURE_3sfi| PDB=3sfi | SCENE= }}
 
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===Ethionamide Boosters Part 2: Combining Bioisosteric Replacement and Structure-Based Drug Design to Solve Pharmacokinetic Issues in a Series of Potent 1,2,4-Oxadiazole EthR Inhibitors.===
 
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{{ABSTRACT_PUBMED_22098589}}
 
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==Function==
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==Ethionamide Boosters Part 2: Combining Bioisosteric Replacement and Structure-Based Drug Design to Solve Pharmacokinetic Issues in a Series of Potent 1,2,4-Oxadiazole EthR Inhibitors.==
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[[http://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>
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<StructureSection load='3sfi' size='340' side='right'caption='[[3sfi]], [[Resolution|resolution]] 2.31&Aring;' scene=''>
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== Structural highlights ==
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<table><tr><td colspan='2'>[[3sfi]] is a 1 chain structure with sequence from [https://en.wikipedia.org/wiki/Mycobacterium_tuberculosis Mycobacterium tuberculosis]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3SFI OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=3SFI FirstGlance]. <br>
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</td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 2.31&#8491;</td></tr>
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<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=3SF:5,5,5-TRIFLUORO-1-{4-[3-(1,3-THIAZOL-2-YL)-1,2,4-OXADIAZOL-5-YL]PIPERIDIN-1-YL}PENTAN-1-ONE'>3SF</scene></td></tr>
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<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=3sfi FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=3sfi OCA], [https://pdbe.org/3sfi PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=3sfi RCSB], [https://www.ebi.ac.uk/pdbsum/3sfi PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=3sfi ProSAT]</span></td></tr>
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</table>
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== Function ==
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[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>
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==About this Structure==
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==See Also==
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[[3sfi]] is a 1 chain structure with sequence from [http://en.wikipedia.org/wiki/Uncultured_bacterium_'eubacterium_sp.' Uncultured bacterium 'eubacterium sp.']. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=3SFI OCA].
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*[[Tetracycline repressor protein 3D structures|Tetracycline repressor protein 3D structures]]
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== References ==
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==Reference==
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<references/>
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<ref group="xtra">PMID:022098589</ref><references group="xtra"/><references/>
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__TOC__
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[[Category: Uncultured bacterium 'eubacterium sp.']]
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</StructureSection>
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[[Category: Baulard, A R.]]
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[[Category: Large Structures]]
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[[Category: Blondiaux, N.]]
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[[Category: Mycobacterium tuberculosis]]
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[[Category: Brodin, P.]]
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[[Category: Baulard AR]]
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[[Category: Christophe, T.]]
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[[Category: Blondiaux N]]
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[[Category: Desroses, M.]]
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[[Category: Brodin P]]
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[[Category: Flament, M P.]]
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[[Category: Christophe T]]
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[[Category: Flipo, M.]]
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[[Category: D prez B]]
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[[Category: Jeon, H K.]]
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[[Category: Desroses M]]
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[[Category: Lecat-Guillet, N.]]
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[[Category: Flament MP]]
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[[Category: Leroux, F.]]
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[[Category: Flipo M]]
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[[Category: Locht, C.]]
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[[Category: Jeon HK]]
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[[Category: Mathys, V.]]
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[[Category: Lecat-Guillet N]]
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[[Category: Piveteau, C.]]
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[[Category: Leroux F]]
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[[Category: Siepmann, J.]]
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[[Category: Locht C]]
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[[Category: Soror, S H.]]
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[[Category: Mathys V]]
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[[Category: Villemagne, B.]]
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[[Category: Piveteau C]]
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[[Category: Villeret, V.]]
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[[Category: Siepmann J]]
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[[Category: Willand, N]]
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[[Category: Soror SH]]
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[[Category: Wintjens, R.]]
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[[Category: Villemagne B]]
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[[Category: Wohlkonig, A.]]
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[[Category: Villeret V]]
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[[Category: Prez, BD.]]
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[[Category: Willand N]]
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[[Category: Dna]]
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[[Category: Wintjens R]]
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[[Category: Dna binding protein]]
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[[Category: Wohlkonig A]]
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[[Category: Inhibitor]]
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[[Category: Tetr-family]]
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[[Category: Transcription repressor-inhibitor complex]]
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[[Category: Transcritptional regulatory repressor]]
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Current revision

Ethionamide Boosters Part 2: Combining Bioisosteric Replacement and Structure-Based Drug Design to Solve Pharmacokinetic Issues in a Series of Potent 1,2,4-Oxadiazole EthR Inhibitors.

PDB ID 3sfi

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