Factorising ligand affinity: A Combined thermodynamic and crystallographic study of trypsin and thrombin inhibition

Journal of Molecular Biology

Volumn 313, Issue 3, 2001, Pages 593-614

  Dullweber, Frank ^a   Stubbs, Milton T ^a   Musil, Dorde ^b   Stürzebecher, Jörg ^c   Klebe, Gerhard ^a  

^a PHILIPPS UNIVERSITY MARBURG   (Germany)

^b ASTRAZENECA R AND D   (Sweden)

^c FRIEDRICH SCHILLER UNIVERSITY JENA   (Germany)

Author keywords

Drug design; Enthalpy entropy compensation; Isothermal titration calorimetry; Thermodynamics; X ray crystallography

Indexed keywords

ALKALI; SODIUM ION; THROMBIN; TRYPSIN; WATER;

ARTICLE; BINDING AFFINITY; CRYSTALLOGRAPHY; ENTHALPY; ENTROPY; ENZYME INHIBITION; HYDROGEN BOND; HYDROPHOBICITY; LIGAND BINDING; PKA; PRIORITY JOURNAL; PROTEIN STABILITY; PROTON TRANSPORT; THERMODYNAMICS;

EID: 0035955550     PISSN: 00222836     EISSN: None     Source Type: Journal    
DOI: 10.1006/jmbi.2001.5062     Document Type: Article

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