3M3R
crystal structure of the m113f alpha-hemolysin mutant complexed with beta-cyclodextrin
Total interactions analyzed 21
Total true interactions 18
Strongest Interaction Chains B-C
Int. Res. 260
Norm. En. per Res. -4.8235
Hub Node A(5)
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 -301.294 -94.1545 -801.218 -1196.6665 258 62 14 30850 10 75 79
A-C -14.3313 5.4505 -31.7598 -40.6406 32 1 0 1235 0 4 3
A-D 0.0 0.0 -0.0842 -0.0842 2 0 0 12 0 0 0
A-F -20.6933 6.7174 -33.485 -47.4609 32 2 0 1286 0 5 3
A-G -366.0247 -95.588 -786.624 -1248.2367 262 80 14 31125 10 73 80
B-C -362.8377 -101.4895 -789.795 -1254.1222 260 68 15 30767 9 73 79
B-D -20.3852 6.6872 -34.8257 -48.5237 35 0 0 1327 0 5 2
B-F 0.0 0.0 -0.0007 -0.0007 2 0 0 2 0 0 0
B-G -19.0067 6.5487 -34.6659 -47.1239 31 2 0 1348 0 6 3
C-D -319.1636 -90.7783 -800.868 -1210.8099 262 72 13 31053 10 74 79
C-E -22.0765 6.6373 -30.5122 -45.9514 31 2 0 1237 0 4 3
C-G 0.0 0.0 -0.0231 -0.0231 2 0 0 6 0 0 0
D-E -329.3939 -99.855 -764.524 -1193.7728 254 68 15 30363 10 73 80
D-F -12.6424 6.6935 -30.5314 -36.4803 31 1 0 1149 0 6 3
D-G 0.0 0.0 -0.1813 -0.1813 2 0 0 20 0 0 0
E-F -312.2006 -95.941 -806.15 -1214.2916 254 73 13 31007 8 73 79
E-G -11.8272 6.5882 -37.5807 -42.8196 34 2 0 1440 0 7 3
F-G -310.3071 -94.46 -789.921 -1194.6881 263 73 14 30691 9 74 79