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211 related items for PubMed ID: 17388313

  • 1. Antibiotic binding to dizinc beta-lactamase L1 from Stenotrophomonas maltophilia: SCC-DFTB/CHARMM and DFT studies.
    Xu D, Guo H, Cui Q.
    J Phys Chem A; 2007 Jul 05; 111(26):5630-6. PubMed ID: 17388313
    [Abstract] [Full Text] [Related]

  • 2. Antibiotic deactivation by a dizinc beta-lactamase: mechanistic insights from QM/MM and DFT studies.
    Xu D, Guo H, Cui Q.
    J Am Chem Soc; 2007 Sep 05; 129(35):10814-22. PubMed ID: 17691780
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  • 3. Structural insights into the design of inhibitors for the L1 metallo-beta-lactamase from Stenotrophomonas maltophilia.
    Nauton L, Kahn R, Garau G, Hernandez JF, Dideberg O.
    J Mol Biol; 2008 Jan 04; 375(1):257-69. PubMed ID: 17999929
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  • 4. Hybrid QM/MM and DFT investigations of the catalytic mechanism and inhibition of the dinuclear zinc metallo-beta-lactamase CcrA from Bacteroides fragilis.
    Park H, Brothers EN, Merz KM.
    J Am Chem Soc; 2005 Mar 30; 127(12):4232-41. PubMed ID: 15783205
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  • 5. Molecular dynamics and density functional theory studies of substrate binding and catalysis of human brain aspartoacylase.
    Zhang CH, Gao JY, Chen ZQ, Xue Y.
    J Mol Graph Model; 2010 Jun 30; 28(8):799-806. PubMed ID: 20227313
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  • 6. Antibiotic binding to monozinc CphA beta-lactamase from Aeromonas hydropila: quantum mechanical/molecular mechanical and density functional theory studies.
    Xu D, Zhou Y, Xie D, Guo H.
    J Med Chem; 2005 Oct 20; 48(21):6679-89. PubMed ID: 16220984
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  • 7. New Delhi metallo-β-lactamase I: substrate binding and catalytic mechanism.
    Zheng M, Xu D.
    J Phys Chem B; 2013 Oct 03; 117(39):11596-607. PubMed ID: 24025144
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  • 9. Inhibitor binding by metallo-beta-lactamase IMP-1 from Pseudomonas aeruginosa: quantum mechanical/molecular mechanical simulations.
    Wang C, Guo H.
    J Phys Chem B; 2007 Aug 23; 111(33):9986-92. PubMed ID: 17663582
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  • 15. Bulgecin A: a novel inhibitor of binuclear metallo-beta-lactamases.
    Simm AM, Loveridge EJ, Crosby J, Avison MB, Walsh TR, Bennett PM.
    Biochem J; 2005 May 01; 387(Pt 3):585-90. PubMed ID: 15569001
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  • 16. Crystal structure of extended-spectrum beta-lactamase Toho-1: insights into the molecular mechanism for catalytic reaction and substrate specificity expansion.
    Ibuka AS, Ishii Y, Galleni M, Ishiguro M, Yamaguchi K, Frère JM, Matsuzawa H, Sakai H.
    Biochemistry; 2003 Sep 16; 42(36):10634-43. PubMed ID: 12962487
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  • 17. What is so special about Arg 55 in the catalysis of cyclophilin A? insights from hybrid QM/MM simulations.
    Li G, Cui Q.
    J Am Chem Soc; 2003 Dec 10; 125(49):15028-38. PubMed ID: 14653737
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  • 19. Hydroxyl groups in the betabeta sandwich of metallo-beta-lactamases favor enzyme activity: Tyr218 and Ser262 pull down the lid.
    Oelschlaeger P, Pleiss J.
    J Mol Biol; 2007 Feb 09; 366(1):316-29. PubMed ID: 17157873
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  • 20. Molecular dynamics simulations of the dinuclear zinc-beta-lactamase from Bacteroides fragilis complexed with imipenem.
    Suárez D, Díaz N, Merz KM.
    J Comput Chem; 2002 Dec 09; 23(16):1587-600. PubMed ID: 12395427
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