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For a full dataset and details of experiment click on the datum link or any thermodynamic datum in the table below.

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DatumProteinLigandΔG (kJ/mol)ΔH (kJ/mol)TΔS (kJ/mol)KD (µM)ΔCp (J/mol)
Link Trypsin N-alpha-(2-naphthylsulfonyl)-n-(3-amidino-l-phenylalaninyl)-d-pipecolinic acid-variant-1a N-alpha-(2-naphthylsulfonyl)-n-(3-amidino-l-phenylalaninyl)-d-pipecolinic acid-variant-1a diagram
N-alpha-(2-naphthylsulfonyl)-n-(3-amidino-l-phenylalaninyl)-d-pipecolinic acid-variant-1a 		-42.5 -27.1 15.4 0.04
Link Trypsin N-alpha-(2-naphthylsulfonyl)-n-(3-amidino-l-phenylalaninyl)-d-pipecolinic acid N-alpha-(2-naphthylsulfonyl)-n-(3-amidino-l-phenylalaninyl)-d-pipecolinic acid diagram
N-alpha-(2-naphthylsulfonyl)-n-(3-amidino-l-phenylalaninyl)-d-pipecolinic acid 		-36.4 -20.6 15.8 0.41 -2.59
Link Trypsin N-alpha-(2-naphthylsulfonyl)-n-(3-amidino-l-phenylalaninyl)-d-pipecolinic acid-variant-1bme N-alpha-(2-naphthylsulfonyl)-n-(3-amidino-l-phenylalaninyl)-d-pipecolinic acid-variant-1bme diagram
N-alpha-(2-naphthylsulfonyl)-n-(3-amidino-l-phenylalaninyl)-d-pipecolinic acid-variant-1bme 		-37.0 -16.9 20.6 0.32 -2.79
Link Trypsin N-alpha-(2-naphthylsulfonyl)-n(3-amidino-l-phenylalaninyl)isopipecolinic acid methyl ester-variant-1c N-alpha-(2-naphthylsulfonyl)-n(3-amidino-l-phenylalaninyl)isopipecolinic acid methyl ester-variant-1c diagram
N-alpha-(2-naphthylsulfonyl)-n(3-amidino-l-phenylalaninyl)isopipecolinic acid methyl ester-variant-1c 		-35.5 -26.8 8.7 0.6 -2.26
Link Trypsin N-alpha-(2-naphthylsulfonyl)-n(3-amidino-l-phenylalaninyl)isopipecolinic acid methyl ester N-alpha-(2-naphthylsulfonyl)-n(3-amidino-l-phenylalaninyl)isopipecolinic acid methyl ester diagram
N-alpha-(2-naphthylsulfonyl)-n(3-amidino-l-phenylalaninyl)isopipecolinic acid methyl ester 		-43.6 -39.6 4.0 0.02 -2.6
Link Trypsin N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide diagram
N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide 		-40.8 -32.9 7.9 0.07 -2.2
Link Trypsin N-alpha-(2-naphthylsulfonyl)-n(3-amidino-l-phenylalaninyl)-4-acetyl-piperazine N-alpha-(2-naphthylsulfonyl)-n(3-amidino-l-phenylalaninyl)-4-acetyl-piperazine diagram
N-alpha-(2-naphthylsulfonyl)-n(3-amidino-l-phenylalaninyl)-4-acetyl-piperazine 		-42.6 -34.4 8.2 0.03 -2.56
Link Trypsin N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 diagram
N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 		-32.0 -4.4 27.6 2.5 -0.91
Link Trypsin [N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine [N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine diagram
[N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine 		-38.3 -24.7 10.6 0.19 -1.2
Link Thrombin Heavy Chain, Residues 364-622 N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 diagram
N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 		-52.2 -48.7 3.5 0.0
Link Alpha-Thrombin N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2et N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2et diagram
N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2et 		-40.3 -24.4 15.9 0.09
Link Alpha-Thrombin [N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine [N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine diagram
[N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine 		-49.2 -48.5 0.7 0.0
Link Alpha-Thrombin {[(1r)-2-((2s)-2-{[(3-{[amino(imino)methyl]amino}propyl)amino]carbonyl}piperidinyl)-1-(cyclohexylmethyl)-2-oxoethyl]amino}acetic acid {[(1r)-2-((2s)-2-{[(3-{[amino(imino)methyl]amino}propyl)amino]carbonyl}piperidinyl)-1-(cyclohexylmethyl)-2-oxoethyl]amino}acetic acid diagram
{[(1r)-2-((2s)-2-{[(3-{[amino(imino)methyl]amino}propyl)amino]carbonyl}piperidinyl)-1-(cyclohexylmethyl)-2-oxoethyl]amino}acetic acid 		-47.8 -57.8 -10.0 0.0
Link Alpha-Thrombin [((1r)-2-{(2s)-2-[({4-[amino(imino)methyl]benzyl}amino)carbonyl]azetidinyl}-1-cyclohexyl-2-oxoethyl)amino]acetic acid [((1r)-2-{(2s)-2-[({4-[amino(imino)methyl]benzyl}amino)carbonyl]azetidinyl}-1-cyclohexyl-2-oxoethyl)amino]acetic acid diagram
[((1r)-2-{(2s)-2-[({4-[amino(imino)methyl]benzyl}amino)carbonyl]azetidinyl}-1-cyclohexyl-2-oxoethyl)amino]acetic acid 		-47.9 -37.0 10.9 0.0
Link Alpha-Thrombin N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 diagram
N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 		-2.31
Link Alpha-Thrombin N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 diagram
N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2 		-3.14
Link Alpha-Thrombin N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2et N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2et diagram
N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2et 		-2.07
Link Alpha-Thrombin N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2et N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2et diagram
N-alpha-(2-naphthylsulfonyl)-3-amidino-l-phenylalanine piperazide-version-2et 		-2.51
Link Alpha-Thrombin [N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine [N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine diagram
[N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine 		-2.77
Link Alpha-Thrombin [N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine [N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine diagram
[N-[n-(4-methoxy-2,3,6-trimethylphenylsulfonyl)-l-aspartyl]-d-(4-amidino-phenylalanyl)]-piperidine 		-3.64

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