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2Y71

Structure of Mycobacterium tuberculosis type II dehydroquinase complexed with (1R,4S,5R)-1,4,5-trihydroxy-3-((5-methylbenzo(b) thiophen-2-yl)methoxy)cyclohex-2-enecarboxylate

Summary for 2Y71
Entry DOI10.2210/pdb2y71/pdb
Related1H05 1H0R 1H0S 2DHQ 2XB8 2Y76 2Y77
Descriptor3-DEHYDROQUINATE DEHYDRATASE, (1R,4S,5R)-1,4,5-trihydroxy-3-[(5-methyl-1-benzothiophen-2-yl)methoxy]cyclohex-2-ene-1-carboxylic acid, SODIUM ION, ... (5 entities in total)
Functional Keywordslyase, amino acid biosynthesis
Biological sourceMYCOBACTERIUM TUBERCULOSIS
Total number of polymer chains1
Total formula weight16553.42
Authors
Otero, J.M.,Llamas-Saiz, A.L.,Fox, G.C.,Tizon, L.,Prazeres, V.F.V.,Lamb, H.,Hawkins, A.R.,Ainsa, J.A.,Castedo, L.,Gonzalez-Bello, C.,van Raaij, M.J. (deposition date: 2011-01-28, release date: 2011-08-17, Last modification date: 2023-12-20)
Primary citationTizon, L.,Otero, J.M.,Prazeres, V.F.,Llamas-Saiz, A.L.,Fox, G.C.,van Raaij, M.J.,Lamb, H.,Hawkins, A.R.,Ainsa, J.A.,Castedo, L.,Gonzalez-Bello, C.
A prodrug approach for improving antituberculosis activity of potent Mycobacterium tuberculosis type II dehydroquinase inhibitors.
J. Med. Chem., 54:6063-6084, 2011
Cited by
PubMed: 21780742
DOI: 10.1021/jm2006063
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.5 Å)
Structure validation

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