Calorimetry and thermodynamics in drug design

被引：295

作者：

Chaires, Jonathan B. ^{[1
]}

机构：

[1] Univ Louisville, James Graham Brown Canc Ctr, Louisville, KY 40202 USA

来源：

ANNUAL REVIEW OF BIOPHYSICS | 2008年 / 37卷

关键词：

free energy; enthalpy; entropy; binding; rational drug design;

D O I：

10.1146/annurev.biophys.36.040306.132812

中图分类号：

Q6 [生物物理学];

学科分类号：

071011 ;

摘要：

Modern instrumentation for calorimetry permits direct determination of enthalpy values for binding reactions and conformational transitions in biomolecules. Complete thermodynamic profiles consisting of free energy, enthalpy, and entropy may be obtained for reactions of interest in a relatively straightforward manner. Such profiles are of enormous value in drug design because they provide information about the balance of driving forces that cannot be obtained from structural or computational methods alone. This perspective shows several examples of the insight provided by thermodynamic data in drug design.

引用

页码：135 / 151

页数：17

共 85 条

[1] The Gibbs conference on biothermodynamics: Origins and evolution [J].

Ackers, GK ;

Bolen, DW .

BIOPHYSICAL CHEMISTRY, 1997, 64 (1-3) :3-5

[2]

Amzel LM, 1997, PROTEINS, V28, P144

[3]

Amzel LM, 2000, METHOD ENZYMOL, V323, P167

[4]

[Anonymous], 1784, MEMOIRE CHALEUR HIST

[5] THE INTERACTION OF INTERCALATING DRUGS WITH NUCLEIC-ACIDS [J].

BERMAN, HM ;

YOUNG, PR .

ANNUAL REVIEW OF BIOPHYSICS AND BIOENGINEERING, 1981, 10 :87-114

[6] Energetic basis of molecular recognition in a DNA aptamer [J].

Bishop, G. Reid ;

Ren, Jinsong ;

Polander, Brandon C. ;

Jeanfreau, Benjamin D. ;

Trent, John O. ;

Chaires, Jonathan B. .

BIOPHYSICAL CHEMISTRY, 2007, 126 (1-3) :165-175

[7] Entropy in protein folding and in protein-protein interactions [J].

Brady, GP ;

Sharp, KA .

CURRENT OPINION IN STRUCTURAL BIOLOGY, 1997, 7 (02) :215-221

[8] STUDY OF STRONG TO ULTRATIGHT PROTEIN INTERACTIONS USING DIFFERENTIAL SCANNING CALORIMETRY [J].

BRANDTS, JF ;

LIN, LN .

BIOCHEMISTRY, 1990, 29 (29) :6927-6940

[9] Decrypting the biochemical function of an essential gene from Streptococcus pneumoniae using ThermoFluor® technology [J].

Carver, TE ;

Bordeau, B ;

Cummings, MD ;

Petrella, EC ;

Pucci, MJ ;

Zawadzke, LE ;

Dougherty, BA ;

Tredup, JA ;

Bryson, JW ;

Yanchunas, J ;

Doyle, ML ;

Witmer, MR ;

Nelen, MI ;

DesJarlais, RL ;

Jaeger, EP ;

Devine, H ;

Asel, ED ;

Springer, BA ;

Bone, R ;

Salemme, FR ;

Todd, MJ .

JOURNAL OF BIOLOGICAL CHEMISTRY, 2005, 280 (12) :11704-11712

[10] Structure-based design fill of a new bisintercalating anthracycline antibiotic [J].

Chaires, JB ;

Leng, FF ;

Przewloka, T ;

Fokt, I ;

Ling, YH ;

PerezSoler, R ;

Priebe, W .

JOURNAL OF MEDICINAL CHEMISTRY, 1997, 40 (03) :261-266

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