For a full dataset and details of experiment click on the datum link or any thermodynamic datum in the table below.
Datum | Protein | Ligand | ΔG (kJ/mol) | ΔH (kJ/mol) | TΔS (kJ/mol) | KD (µM) | ΔCp (J/mol) |
Link |
Purine Nucleoside Phosphorylase
|
Adenosine
Adenosine
|
-23.88
|
-96.23
|
-72.35
|
62.11
|
|
Link |
Purine Nucleoside Phosphorylase
|
Guanosine
Guanosine
|
-23.56
|
-99.16
|
-75.6
|
80.0
|
|
Link |
Disabled Homolog 1 (native)
|
TKSMNFDNPVYRKT
TKSMNFDNPVYRKT
|
-32.22
|
-40.17
|
-7.95
|
3.0
|
|
Link |
Disabled Homolog 1 (H81A)
|
TKSMNFDNPVYRKT
TKSMNFDNPVYRKT
|
-46.86
|
-48.53
|
-1.67
|
3.2
|
|
Link |
Disabled Homolog 1 (H81Q)
|
TKSMNFDNPVYRKT
TKSMNFDNPVYRKT
|
-33.05
|
-45.19
|
-12.13
|
1.6
|
|
Link |
Disabled Homolog 1 (K45A)
|
TKSMNFDNPVYRKT
TKSMNFDNPVYRKT
|
-32.22
|
-42.26
|
-10.04
|
2.3
|
|
Link |
Disabled Homolog 1 (K45Q)
|
TKSMNFDNPVYRKT
TKSMNFDNPVYRKT
|
-31.38
|
-33.89
|
-2.51
|
2.9
|
|
Link |
Disabled Homolog 1 (K45E)
|
TKSMNFDNPVYRKT
TKSMNFDNPVYRKT
|
-32.22
|
-44.35
|
-12.13
|
2.2
|
|
Link |
Disabled Homolog 1 (K82A)
|
TKSMNFDNPVYRKT
TKSMNFDNPVYRKT
|
-33.47
|
-46.02
|
-12.55
|
1.4
|
|
Link |
Disabled Homolog 1 (K82Q)
|
TKSMNFDNPVYRKT
TKSMNFDNPVYRKT
|
-33.05
|
-60.67
|
-27.61
|
1.7
|
|
Link |
Disabled Homolog 1 (K45A/K82A)
|
TKSMNFDNPVYRKT
TKSMNFDNPVYRKT
|
-31.38
|
-36.82
|
-5.44
|
3.0
|
|
Link |
Disabled Homolog 1 (K45Q/K82Q)
|
TKSMNFDNPVYRKT
TKSMNFDNPVYRKT
|
-31.8
|
-38.91
|
-7.11
|
2.7
|
|
Link |
Disabled Homolog 1 (K45E/K82Q)
|
TKSMNFDNPVYRKT
TKSMNFDNPVYRKT
|
-32.22
|
-42.68
|
-10.46
|
2.1
|
|
Link |
Disabled Homolog 1 (native)
|
D-myo-inositol-1,4,5-triphosphate
D-myo-inositol-1,4,5-triphosphate
|
-33.89
|
-80.33
|
-46.44
|
1.2
|
|
Link |
Disabled Homolog 1 (H81A)
|
D-myo-inositol-1,4,5-triphosphate
D-myo-inositol-1,4,5-triphosphate
|
-27.61
|
-46.86
|
-19.25
|
24.0
|
|
Link |
Disabled Homolog 1 (H81Q)
|
D-myo-inositol-1,4,5-triphosphate
D-myo-inositol-1,4,5-triphosphate
|
-26.78
|
-41.0
|
-14.23
|
18.0
|
|
Link |
Disabled Homolog 1 (S114Y)
|
D-myo-inositol-1,4,5-triphosphate
D-myo-inositol-1,4,5-triphosphate
|
-33.89
|
-102.09
|
-68.2
|
1.2
|
|
Link |
Disabled Homolog 1 (F158V)
|
D-myo-inositol-1,4,5-triphosphate
D-myo-inositol-1,4,5-triphosphate
|
-35.56
|
-75.73
|
-40.17
|
0.6
|
|
Link |
Nucleoside Diphosphate Kinase (variant 1)
|
Adenosine-5'-diphosphate
Adenosine-5'-diphosphate
|
-22.05
|
-17.57
|
4.6
|
117.1
|
|
Link |
Nucleoside Diphosphate Kinase (variant 1)
|
Guanosine-5'-diphosphate
Guanosine-5'-diphosphate
|
-24.02
|
-23.01
|
1.26
|
52.08
|
|