2WKS

Structure of Helicobacter pylori Type II Dehydroquinase with a new carbasugar-thiophene inhibitor.

Summary for 2WKS

Entry DOI	10.2210/pdb2wks/pdb
Related	1J2Y 2C4V 2C4W 2C57
Descriptor	3-DEHYDROQUINATE DEHYDRATASE, (1R,4S,5R)-1,4,5-trihydroxy-3-[(5-methyl-1-benzothiophen-2-yl)methoxy]cyclohex-2-ene-1-carboxylic acid (3 entities in total)
Functional Keywords	aromatic amino acid biosynthesis, lyase, shikimic acid pathway, 3-dehydroquinate dehydratase
Biological source	HELICOBACTER PYLORI
Total number of polymer chains	6
Total formula weight	113097.79
Authors	Otero, J.M.,Guardado-Calvo, P.,Llamas-Saiz, A.L.,Prazeres, V.F.V.,Tizon, L.,Castedo, L.,Lamb, H.,Hawkins, A.R.,Gonzalez-Bello, C.,van Raaij, M.J. (deposition date: 2009-06-17, release date: 2009-11-24, Last modification date: 2023-12-13)
Primary citation	Prazeres, V.F.,Tizon, L.,Otero, J.M.,Guardado-Calvo, P.,Llamas-Saiz, A.L.,van Raaij, M.J.,Castedo, L.,Lamb, H.,Hawkins, A.R.,Gonzalez-Bello, C. Synthesis and biological evaluation of new nanomolar competitive inhibitors of Helicobacter pylori type II dehydroquinase. Structural details of the role of the aromatic moieties with essential residues. J. Med. Chem., 53:191-200, 2010 Cited by PubMed: 19911771 DOI: 10.1021/jm9010466 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.95 Å)

Structure validation