3P76

X-ray crystal structure of Aquifex aeolicus LpxC complexed SCH1379777

Summary for 3P76

• Entry DOI: 10.2210/pdb3p76/pdb
• Descriptor: UDP-3-O-[3-hydroxymyristoyl] N-acetylglucosamine deacetylase, IMIDAZOLE, N-[(1S,2R)-2-hydroxy-1-(hydroxycarbamoyl)propyl]-4-[4-(phenylethynyl)phenyl]piperidine-1-carboxamide, ... (5 entities in total)
• Functional Keywords: amidohydrolases, amino acid motifs, binding sites, drug design, enzyme inhibitors, escherichia coli proteins, hydrophobicity, lipid a, protein conformation, protein folding, recombinant fusion proteins, structure-activity relationship, hydrolase
• Biological source: Aquifex aeolicus
• Total number of polymer chains: 1
• Total formula weight: 31610.90

Authors

Orth, P. (deposition date: 2010-10-12, release date: 2011-02-09, Last modification date: 2023-09-06)

• Primary citation: Faruk Mansoor, U.,Vitharana, D.,Reddy, P.A.,Daubaras, D.L.,McNicholas, P.,Orth, P.,Black, T.,Arshad Siddiqui, M.; Design and synthesis of potent Gram-negative specific LpxC inhibitors.; Bioorg.Med.Chem.Lett., 21:1155-1161, 2011; PubMed: 21273067; DOI: 10.1016/j.bmcl.2010.12.111

Experimental method

X-RAY DIFFRACTION (1.93 Å)