3DUF
snapshots of catalysis in the e1 subunit of the pyruvate dehydrogenase multi-enzyme complex
Total interactions analyzed 45
Total true interactions 18
Strongest Interaction Chains H-J
Int. Res. 30
Norm. En. per Res. -4.4784
Hub Node A(4)
Click on the Nodes or Edges in the network to see the details
Weak Strong
Width of edge <-> No. of inter. res.
All Interactions
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Chains Hydro. Bond Ener. (kJ/mol) Elec. Ener. (kJ/mol) VDW. Ener. (kJ/mol) Tot. Stab. Ener. (kJ/mol) #int. res. # Short cont. #Hydr. int. #VDW pairs #salt bridges #Pot. fav. elec. int #Pot. unfav. elec. int int. res.
A-B -45.954 9.8471 -463.013 -499.1199 163 6 8 18333 4 31 28
A-C -57.0565 -4.5198 -453.31 -514.8863 178 19 26 18796 0 14 17
A-D -45.3266 -29.7096 -296.423 -371.4593 149 14 7 13074 3 33 35
A-F 0.0 -3.705 -2.4941 -6.1991 10 0 0 302 0 3 3
B-C -43.8002 13.5218 -294.767 -325.0455 146 25 9 12989 1 34 37
B-D -53.5113 -58.0368 -495.229 -606.7771 175 15 9 19168 11 30 32
B-I -5.9668 0.0 -50.3375 -56.3043 27 2 0 1944 0 6 2
C-D -64.5041 12.1235 -457.141 -509.5216 160 11 7 18345 3 30 27
C-F 0.0 -11.2208 -18.9577 -30.1785 43 4 0 1175 2 21 23
D-I -37.7424 -26.9027 -72.0887 -136.7339 32 4 2 3223 1 10 7
E-F -52.9145 12.0365 -429.247 -470.125 156 15 7 17185 4 28 28
E-G -69.963 -4.4946 -448.574 -523.0316 180 18 26 19087 0 14 18
E-H -36.1195 -23.5411 -282.326 -341.9866 151 20 8 13245 2 37 40
F-G -39.5964 6.9011 -299.916 -332.6113 149 16 7 13282 1 34 36
F-H -42.8606 -54.979 -473.398 -571.2376 173 20 9 18922 13 30 32
F-J 0.0 0.0 -27.9795 -27.9795 23 1 0 1455 0 5 1
G-H -64.3112 -2.1111 -456.724 -523.1463 159 10 8 18140 5 30 26
H-J -14.6624 -43.0171 -76.6736 -134.3531 30 3 2 3097 3 8 6