3FYT
crystal structure of bacillus pumilus acetyl xylan esterase s181a mutant in complex with beta-d-xylopyranose
Total interactions analyzed 66
Total true interactions 24
Strongest Interaction Chains A-C
Int. Res. 40
Norm. En. per Res. -4.6139
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
Download
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 -10.5708 -73.121 -76.8675 -160.5593 41 0 1 2669 5 9 8
A-C -28.1076 -71.5142 -84.9361 -184.5579 40 6 1 2859 5 10 9
A-E -29.5214 0.0 -200.779 -230.3004 93 4 2 8655 0 20 28
A-F -109.5147 -0.0564 -358.622 -468.1931 118 16 0 11383 0 26 33
B-C -24.0277 -68.3011 -77.2572 -169.5859 37 1 1 2616 5 9 8
B-D -121.358 -1.4107 -375.372 -498.1407 118 22 0 11635 0 26 35
B-F -29.896 0.0 -188.59 -218.486 92 8 3 8371 0 20 28
C-D -29.3815 0.0 -188.978 -218.3595 92 5 2 8348 0 20 28
C-E -114.8071 -1.2935 -365.331 -481.4317 119 19 0 11411 0 26 34
D-E -18.5576 -69.7368 -87.1191 -175.4135 39 1 1 3023 5 9 9
D-F -17.0231 -69.8586 -76.1053 -162.987 39 0 1 2599 5 9 8
E-F -18.7238 -70.2302 -78.9584 -167.9124 40 0 1 2679 5 9 9
G-H -15.0433 -68.9294 -77.4847 -161.4575 36 0 1 2646 5 9 7
G-I -6.2441 -68.9354 -77.6577 -152.8373 36 1 1 2623 4 9 8
G-L -11.7187 0.0 -192.39 -204.1087 97 7 3 8447 0 20 28
G-M -116.8844 -1.7321 -338.902 -457.5186 116 16 0 11227 0 26 34
H-I -6.5883 -68.198 -73.0618 -147.8481 36 0 1 2543 5 9 8
H-L -118.775 2.0521 -348.085 -464.8079 118 19 0 11362 0 27 32
H-N -18.7511 0.0 -212.517 -231.2681 97 12 3 8884 0 20 28
I-M -26.181 0.0 -202.939 -229.12 96 7 3 8581 0 20 28
I-N -136.5694 -2.2512 -380.314 -519.1347 118 23 0 11750 0 27 34
L-M -19.5225 -69.3614 -84.8674 -173.7513 40 3 1 2823 5 10 10
L-N -9.7746 -69.0915 -79.2534 -158.1194 38 1 1 2659 5 9 8
M-N -10.3787 -67.1384 -75.8092 -153.3263 39 1 1 2604 5 9 7