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222 related items for PubMed ID: 20078087

  • 1. Computational modeling of carbohydrate-recognition process in E-selectin complex: structural mapping of sialyl Lewis X onto ab initio QM/MM free energy surface.
    Ishida T.
    J Phys Chem B; 2010 Mar 25; 114(11):3950-64. PubMed ID: 20078087
    [Abstract] [Full Text] [Related]

  • 2. Structure of a selectin-like mutant of mannose-binding protein complexed with sialylated and sulfated Lewis(x) oligosaccharides.
    Ng KK, Weis WI.
    Biochemistry; 1997 Feb 04; 36(5):979-88. PubMed ID: 9033386
    [Abstract] [Full Text] [Related]

  • 3. Conformational studies on the selectin and natural killer cell receptor ligands sulfo- and sialyl-lacto-N-fucopentaoses (SuLNFPII and SLNFPII) using NMR spectroscopy and molecular dynamics simulations. Comparisons with the nonacidic parent molecule LNFPII.
    Kogelberg H, Frenkiel TA, Homans SW, Lubineau A, Feizi T.
    Biochemistry; 1996 Feb 13; 35(6):1954-64. PubMed ID: 8639679
    [Abstract] [Full Text] [Related]

  • 4. Epitope mapping of sialyl Lewis(x) bound to E-selectin using saturation transfer difference NMR experiments.
    Rinnbauer M, Ernst B, Wagner B, Magnani J, Benie AJ, Peters T.
    Glycobiology; 2003 Jun 13; 13(6):435-43. PubMed ID: 12626392
    [Abstract] [Full Text] [Related]

  • 5. Ligand interactions with E-selectin. Identification of a new binding site for recognition of N-acyl aromatic glucosamine substituents of sialyl Lewis X.
    Ramphal JY, Hiroshige M, Lou B, Gaudino JJ, Hayashi M, Chen SM, Chiang LC, Gaeta FC, DeFrees SA.
    J Med Chem; 1996 Mar 29; 39(7):1357-60. PubMed ID: 8691465
    [Abstract] [Full Text] [Related]

  • 6. Design and synthesis of sialyl Lewis(x) mimics as E- and P-selectin inhibitors.
    Kaila N, Thomas BE.
    Med Res Rev; 2002 Nov 29; 22(6):566-601. PubMed ID: 12369089
    [Abstract] [Full Text] [Related]

  • 7. NMR investigations of protein-carbohydrate interactions: studies on the relevance of Trp/Tyr variations in lectin binding sites as deduced from titration microcalorimetry and NMR studies on hevein domains. Determination of the NMR structure of the complex between pseudohevein and N,N',N"-triacetylchitotriose.
    Asensio JL, Siebert HC, von Der Lieth CW, Laynez J, Bruix M, Soedjanaamadja UM, Beintema JJ, Cañada FJ, Gabius HJ, Jiménez-Barbero J.
    Proteins; 2000 Aug 01; 40(2):218-36. PubMed ID: 10842338
    [Abstract] [Full Text] [Related]

  • 8. Selectin-ligand interactions revealed by molecular dynamics simulation in solution.
    Tsujishita H, Hiramatsu Y, Kondo N, Ohmoto H, Kondo H, Kiso M, Hasegawa A.
    J Med Chem; 1997 Jan 31; 40(3):362-9. PubMed ID: 9022803
    [Abstract] [Full Text] [Related]

  • 9. Affinity and kinetics of sialyl Lewis-X and core-2 based oligosaccharides binding to L- and P-selectin.
    Beauharnois ME, Lindquist KC, Marathe D, Vanderslice P, Xia J, Matta KL, Neelamegham S.
    Biochemistry; 2005 Jul 12; 44(27):9507-19. PubMed ID: 15996105
    [Abstract] [Full Text] [Related]

  • 10. Conformational dynamics of sialyl Lewisx in aqueous solution and its interaction with selectinE. A study by molecular dynamics.
    Veluraja K, Margulis CJ.
    J Biomol Struct Dyn; 2005 Aug 12; 23(1):101-11. PubMed ID: 15918681
    [Abstract] [Full Text] [Related]

  • 11. Probing the carbohydrate recognition domain of E-selectin: the importance of the acid orientation in sLex mimetics.
    Titz A, Patton J, Smiesko M, Radic Z, Schwardt O, Magnani JL, Ernst B.
    Bioorg Med Chem; 2010 Jan 01; 18(1):19-27. PubMed ID: 19948406
    [Abstract] [Full Text] [Related]

  • 12. Dynamics of sialyl Lewis(a) in aqueous solution and prediction of the structure of the sialyl Lewis(a)-SelectinE complex.
    Veluraja K, Seethalakshmi AN.
    J Theor Biol; 2008 May 07; 252(1):15-23. PubMed ID: 18343410
    [Abstract] [Full Text] [Related]

  • 13. Structure and function of the epidermal growth factor domain of P-selectin.
    Freedman SJ, Sanford DG, Bachovchin WW, Furie BC, Baleja JD, Furie B.
    Biochemistry; 1996 Oct 29; 35(43):13733-44. PubMed ID: 8901515
    [Abstract] [Full Text] [Related]

  • 14. Quinic acid derivatives as sialyl Lewis(x)-mimicking selectin inhibitors: design, synthesis, and crystal structure in complex with E-selectin.
    Kaila N, Somers WS, Thomas BE, Thakker P, Janz K, DeBernardo S, Tam S, Moore WJ, Yang R, Wrona W, Bedard PW, Crommie D, Keith JC, Tsao DH, Alvarez JC, Ni H, Marchese E, Patton JT, Magnani JL, Camphausen RT.
    J Med Chem; 2005 Jun 30; 48(13):4346-57. PubMed ID: 15974587
    [Abstract] [Full Text] [Related]

  • 15. High affinity fucose binding of Pseudomonas aeruginosa lectin PA-IIL: 1.0 A resolution crystal structure of the complex combined with thermodynamics and computational chemistry approaches.
    Mitchell EP, Sabin C, Snajdrová L, Pokorná M, Perret S, Gautier C, Hofr C, Gilboa-Garber N, Koca J, Wimmerová M, Imberty A.
    Proteins; 2005 Feb 15; 58(3):735-46. PubMed ID: 15573375
    [Abstract] [Full Text] [Related]

  • 16. Crystal structures of the staphylococcal toxin SSL5 in complex with sialyl Lewis X reveal a conserved binding site that shares common features with viral and bacterial sialic acid binding proteins.
    Baker HM, Basu I, Chung MC, Caradoc-Davies T, Fraser JD, Baker EN.
    J Mol Biol; 2007 Dec 14; 374(5):1298-308. PubMed ID: 17996251
    [Abstract] [Full Text] [Related]

  • 17. NMR and modeling studies of protein-carbohydrate interactions: synthesis, three-dimensional structure, and recognition properties of a minimum hevein domain with binding affinity for chitooligosaccharides.
    Aboitiz N, Vila-Perelló M, Groves P, Asensio JL, Andreu D, Cañada FJ, Jiménez-Barbero J.
    Chembiochem; 2004 Sep 06; 5(9):1245-55. PubMed ID: 15368576
    [Abstract] [Full Text] [Related]

  • 18. Conformation of the oligosaccharide receptor for E-selectin.
    Mukhopadhyay C, Miller KE, Bush CA.
    Biopolymers; 1994 Jan 06; 34(1):21-9. PubMed ID: 7509201
    [Abstract] [Full Text] [Related]

  • 19. Reaction path potential for complex systems derived from combined ab initio quantum mechanical and molecular mechanical calculations.
    Lu Z, Yang W.
    J Chem Phys; 2004 Jul 01; 121(1):89-100. PubMed ID: 15260525
    [Abstract] [Full Text] [Related]

  • 20. L-selectin-carbohydrate interactions: relevant modifications of the Lewis x trisaccharide.
    Sanders WJ, Katsumoto TR, Bertozzi CR, Rosen SD, Kiessling LL.
    Biochemistry; 1996 Nov 26; 35(47):14862-7. PubMed ID: 8942649
    [Abstract] [Full Text] [Related]

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