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. Author manuscript; available in PMC: 2012 Apr 15.
Published in final edited form as: J Mol Biol. 2011 Feb 17;407(5):716–730. doi: 10.1016/j.jmb.2011.02.001

Table 3.

Thermodynamic parameters calculated from van’t Hoff plots.

Collision Complex aΔG°
(kcal·mol−1)
bΔH°
(kcal·mol−1)
cΔS°
(cal·mol−1)
TΔS°
(kcal·mol−1)
Kligand (k+ligand/k−ligand) −7.8 ± 0.1 −5.0 ± 0.5 9.2 ± 1.6 −2.7 ± 0.5
Pocket Conformational Change
Kpocket (k+pocket/k−pocket) 0.9 ± 0.2 −5.8 ± 1.3 −22.6 ± 4.5 6.7 ± 1.3
a

Determined from Eq. 13

b

Detemined from Eq. 14

c

Determined from Eq. 15