Cachau RE - Search Results

1

A quantum mechanical model of the hydration and acidity of the active site in aspartic proteases.

Topol IA, Cachau RE, Burt SK, Erickson JW. Topol IA, et al. Among authors: cachau re. Adv Exp Med Biol. 1995;362:549-54. doi: 10.1007/978-1-4615-1871-6_71. Adv Exp Med Biol. 1995. PMID: 8540370 No abstract available.

2

Molecular dynamics of HIV-1 protease in complex with a difluoroketone-containing inhibitor: implications for the catalytic mechanism.

Silva AM, Cachau RE, Baldwin ET, Gulnik S, Sham HL, Erickson JW. Silva AM, et al. Among authors: cachau re. Adv Exp Med Biol. 1995;362:451-4. doi: 10.1007/978-1-4615-1871-6_58. Adv Exp Med Biol. 1995. PMID: 8540356 No abstract available.

3

Computer simulation and analysis of the reaction pathway for the decomposition of the hydrated peptide bond in aspartic proteases.

Cachau RE, Topol IA, Burt SK, Silva AM, Erickson JW. Cachau RE, et al. Adv Exp Med Biol. 1995;362:461-5. doi: 10.1007/978-1-4615-1871-6_60. Adv Exp Med Biol. 1995. PMID: 8540358 No abstract available.

4

Inhibition and catalytic mechanism of HIV-1 aspartic protease.

Silva AM, Cachau RE, Sham HL, Erickson JW. Silva AM, et al. Among authors: cachau re. J Mol Biol. 1996 Jan 19;255(2):321-46. doi: 10.1006/jmbi.1996.0026. J Mol Biol. 1996. PMID: 8551523

5

Quantum chemical modeling of the GTP hydrolysis by the RAS-GAP protein complex.

Topol IA, Cachau RE, Nemukhin AV, Grigorenko BL, Burt SK. Topol IA, et al. Among authors: cachau re. Biochim Biophys Acta. 2004 Jul 1;1700(1):125-36. doi: 10.1016/j.bbapap.2004.04.007. Biochim Biophys Acta. 2004. PMID: 15210132

6

Quantum chemical modeling of reaction mechanism for 2-oxoglutarate dependent enzymes: effect of substitution of iron by nickel and cobalt.

Topol IA, Nemukhin AV, Salnikow K, Cachau RE, Abashkin YG, Kasprzak KS, Burt SK. Topol IA, et al. Among authors: cachau re. J Phys Chem A. 2006 Mar 30;110(12):4223-8. doi: 10.1021/jp055633k. J Phys Chem A. 2006. PMID: 16553373

7

Crystal structures of native and inhibited forms of human cathepsin D: implications for lysosomal targeting and drug design.

Baldwin ET, Bhat TN, Gulnik S, Hosur MV, Sowder RC 2nd, Cachau RE, Collins J, Silva AM, Erickson JW. Baldwin ET, et al. Among authors: cachau re. Proc Natl Acad Sci U S A. 1993 Jul 15;90(14):6796-800. doi: 10.1073/pnas.90.14.6796. Proc Natl Acad Sci U S A. 1993. PMID: 8393577 Free PMC article.

8

Structure and inhibition of plasmepsin II, a hemoglobin-degrading enzyme from Plasmodium falciparum.

Silva AM, Lee AY, Gulnik SV, Maier P, Collins J, Bhat TN, Collins PJ, Cachau RE, Luker KE, Gluzman IY, Francis SE, Oksman A, Goldberg DE, Erickson JW. Silva AM, et al. Among authors: cachau re. Proc Natl Acad Sci U S A. 1996 Sep 17;93(19):10034-9. doi: 10.1073/pnas.93.19.10034. Proc Natl Acad Sci U S A. 1996. PMID: 8816746 Free PMC article.

9

Novel procedure for structure refinement in homology modeling and its application to the human class Mu glutathione S-transferases.

Cachau RE, Erickson JW, Villar HO. Cachau RE, et al. Protein Eng. 1994 Jul;7(7):831-9. doi: 10.1093/protein/7.7.831. Protein Eng. 1994. PMID: 7971945

10

A new addition to the structural bioinformatics toolbox: 3D models of short bioactive peptides from multiple sequences using feedback restrained molecular dynamics (FRMD).

Cachau RE, González-Sapienza G, Burt SK, Ventura ON. Cachau RE, et al. Cell Mol Biol (Noisy-le-grand). 2003 Sep;49(6):973-83. Cell Mol Biol (Noisy-le-grand). 2003. PMID: 14656056

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