3FVR
crystal structure of acetyl xylan esterase from bacillus pumilus, monoclinic crystal form i
Total interactions analyzed 66
Total true interactions 24
Strongest Interaction Chains D-E
Int. Res. 47
Norm. En. per Res. -4.6374
Hub Node A(4)
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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 -10.5377 -69.945 -117.232 -197.7147 49 1 1 4192 5 9 9
A-C -23.4886 -71.3435 -110.095 -204.9271 49 2 1 3876 5 9 10
A-E -21.5903 0.0 -197.53 -219.1203 97 4 3 8577 0 22 28
A-F -129.6617 3.9063 -329.398 -455.1533 116 25 0 11204 0 27 32
B-C -22.6304 -70.8358 -110.755 -204.2212 46 5 1 3935 4 9 9
B-D -136.2776 5.0554 -336.039 -467.2612 118 27 0 11321 0 28 32
B-F -27.3426 2.2592 -206.229 -231.3124 97 11 3 8976 0 22 28
C-D -27.7279 0.0 -200.71 -228.4379 94 6 3 8728 0 22 28
C-E -123.8788 5.3099 -311.546 -430.1149 112 20 0 11075 0 26 32
D-E -14.972 -74.9296 -128.057 -217.9586 47 4 1 4446 5 9 10
D-F -19.0851 -72.3493 -105.115 -196.5495 45 1 1 3681 5 9 8
E-F -17.0802 -67.6128 -110.152 -194.845 46 2 1 3919 5 9 8
G-H -19.6289 -76.6453 -103.819 -200.0933 44 2 1 3717 4 9 8
G-I -7.0443 -73.7854 -99.3643 -180.1941 45 2 1 3793 5 9 8
G-L -23.092 0.0 -192.796 -215.888 95 4 3 8537 0 20 28
G-M -128.652 4.0244 -333.335 -457.9626 115 20 0 11179 0 27 32
H-I -11.0563 -76.5332 -108.208 -195.7975 45 1 1 3715 5 9 8
H-L -130.9915 5.8278 -342.015 -467.1787 117 26 0 11314 0 27 32
H-N -26.1543 0.0 -204.787 -230.9413 96 6 3 8770 0 22 28
I-M -26.7582 0.0 -202.964 -229.7222 96 15 3 9096 0 21 28
I-N -131.7262 4.2283 -346.03 -473.5279 118 22 0 11394 0 27 32
L-M -25.2197 -68.5428 -107.241 -201.0035 46 1 1 3711 5 9 8
L-N -20.1722 -66.7123 -109.138 -196.0225 47 3 1 3768 5 9 8
M-N -18.0162 -68.8214 -115.167 -202.0046 48 3 1 4129 5 9 8