3H6F
crystal structure of mycobacterium tuberculosis proteasome modified by inhibitor ht1171
Total interactions analyzed 378
Total true interactions 70
Strongest Interaction Chains E-H
Int. Res. 53
Norm. En. per Res. -4.9922
Hub Node C(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 -7.9982 -14.7216 -141.017 -163.7368 83 2 2 6918 3 26 26
A-H -34.0359 -84.4676 -140.657 -259.1605 56 5 2 5371 14 37 34
A-O -12.8769 -10.9104 -143.598 -167.3853 84 5 3 6788 3 27 26
A-P -24.2299 0.7116 -93.3472 -116.8656 40 2 1 3417 2 18 20
B-C -42.9515 -69.8014 -135.789 -248.542 60 9 2 5496 14 39 35
B-H -29.8628 -1.2801 -96.9953 -128.1382 41 7 1 3609 2 18 20
B-I -16.5398 -12.8857 -138.508 -167.9335 84 2 3 6678 3 27 25
C-E -77.6514 -86.7658 -182.714 -347.1312 74 6 2 6638 13 26 18
C-H -5.8817 -14.3823 -50.3216 -70.5856 48 0 0 2629 1 22 13
C-I -30.5859 0.1603 -92.187 -122.6127 40 6 1 3399 2 17 20
C-J 0.0 -6.8032 -54.7801 -61.5833 49 2 0 2823 1 23 13
C-R -56.3833 -108.1899 -92.2555 -256.8287 61 5 1 4395 10 30 26
D-E -42.2886 -41.7923 -140.123 -224.2039 56 6 2 5349 14 37 33
D-K -27.5704 -30.1629 -109.699 -167.4323 77 2 1 5870 3 23 23
D-Q -15.495 -11.5932 -166.114 -193.2022 90 16 3 7804 3 26 26
D-R -32.5209 0.9476 -84.0429 -115.6162 40 2 1 3314 2 18 19
E-H -59.0804 -113.0222 -92.4847 -264.5873 53 10 1 4519 10 28 25
E-K -39.7241 -20.384 -87.0868 -147.1949 40 6 1 3411 2 16 19
E-L -9.8483 -34.3839 -56.255 -100.4872 50 2 0 2866 3 24 13
E-R -7.0288 -29.8347 -56.485 -93.3484 50 1 0 2868 2 21 13
F-G -41.1457 -29.8838 -147.759 -218.7885 59 7 2 5613 14 39 36
F-M -15.9327 -16.8448 -147.733 -180.5105 84 2 3 6965 3 26 27
F-N -31.4091 -20.5706 -96.4875 -148.4673 40 8 1 3588 2 18 20
F-W -18.9351 -12.3114 -172.149 -203.3956 89 8 3 7775 2 27 26
G-N 0.0 -22.0061 -59.0265 -81.0326 51 1 0 2880 1 22 13
G-V -67.0739 -85.6414 -180.171 -332.8863 76 5 2 6728 11 29 19
G-W -13.1595 -1.1656 -85.4672 -99.7923 40 3 1 3283 2 17 20
G-X -6.4947 -26.9672 -51.8955 -85.3574 51 2 0 2674 2 20 13
G-2 -56.0032 -111.478 -86.2431 -253.7242 56 10 1 4519 10 28 26
H-L -80.5545 -106.9962 -176.138 -363.6887 73 6 2 6437 12 27 18
H-P -9.528 -31.8452 -52.3431 -93.7163 49 2 0 2789 2 21 13
I-J -45.1152 -69.5093 -150.3 -264.9244 58 7 2 5608 13 38 34
I-S -16.9677 -14.8815 -158.227 -190.0762 85 5 3 7297 3 27 25
J-R -70.2776 -113.0817 -185.227 -368.5864 80 6 2 6905 11 30 20
J-S -26.5308 -20.141 -87.9646 -134.6364 40 1 1 3306 2 16 19
J-T 0.0 -29.3896 -53.2809 -82.6706 48 1 0 2706 2 22 13
J-Z -53.8479 -110.456 -89.3629 -253.6669 55 9 1 4414 10 28 25
K-L -44.4064 -74.9396 -138.301 -257.647 57 6 2 5361 13 37 33
K-M -15.3881 -6.1799 -150.085 -171.653 88 5 3 7182 2 25 26
L-M -40.9728 -20.3081 -92.4931 -153.774 40 6 1 3501 2 17 19
L-N 0.0 -24.1579 -58.0264 -82.1843 49 1 0 2921 2 23 13
L-P -44.4003 -106.3586 -94.869 -245.6279 54 7 1 4444 9 28 25
M-N -44.3399 -36.9982 -139.453 -220.7911 57 4 2 5522 13 37 35
N-P -58.5476 -76.1448 -160.378 -295.0704 72 5 2 6191 13 26 16
N-V -62.2866 -111.4786 -100.745 -274.5102 70 6 1 4744 10 30 27
O-P -42.9538 -68.8516 -146.124 -257.9293 57 11 2 5704 13 38 35
O-U -22.1327 -19.538 -133.962 -175.6327 84 5 3 6953 3 25 27
O-V -28.5624 -10.081 -86.3993 -125.0427 38 6 1 3330 1 16 20
P-V 0.0 -26.4561 -47.4891 -73.9452 51 1 0 2580 1 20 13
Q-R -52.5722 -93.7598 -147.42 -293.752 60 7 2 5546 15 39 36
Q-Y -18.2456 -14.7996 -159.516 -192.5612 92 5 2 7241 3 25 26
Q-Z -30.3257 -1.1894 -94.2563 -125.7714 41 2 1 3466 2 19 20
R-Z 0.0 -22.1528 -54.2152 -76.368 49 1 0 2800 1 23 13
S-T -32.9069 -70.2996 -128.854 -232.0605 56 3 2 5172 14 36 33
S-1 -8.2529 -17.0371 -120.689 -145.9789 79 3 3 6148 3 27 26
T-X -41.604 -107.076 -82.9797 -231.6597 53 8 1 4318 10 28 26
T-Z -69.7767 -100.5909 -181.084 -351.4515 73 6 2 6577 12 27 17
T-1 -30.2335 -19.9595 -94.5284 -144.7215 40 3 1 3506 2 18 19
T-2 0.0 -30.353 -50.3531 -80.7061 49 2 0 2664 1 22 13
U-V -31.8442 -34.8058 -135.675 -202.325 58 7 2 5434 13 38 35
U-1 -12.2731 -8.866 -157.367 -178.5061 87 4 2 7198 3 26 27
U-2 -29.518 -20.8866 -102.2 -152.6046 42 10 1 3795 2 18 22
V-2 -6.1288 -21.5939 -57.1704 -84.8931 48 2 0 2877 1 24 13
W-X -34.0816 -35.9171 -137.343 -207.3417 56 4 2 5289 15 36 34
W-Y -13.9755 -19.3818 -105.28 -138.6373 80 3 1 5657 3 23 23
X-Y -27.3343 1.8519 -87.224 -112.7064 38 2 1 3251 2 17 19
X-Z 0.0 -17.1787 -49.6839 -66.8626 48 1 0 2607 1 21 12
X-2 -71.2983 -86.0896 -168.225 -325.6129 71 6 2 6279 11 26 16
Y-Z -45.0869 -76.5466 -143.288 -264.9215 59 5 2 5466 15 39 34
1-2 -43.5549 -73.4113 -134.048 -251.0142 58 4 2 5188 14 36 32