3SHJ
proteasome in complex with hydroxyurea derivative hu10
Total interactions analyzed 378
Total true interactions 98
Strongest Interaction Chains V-W
Int. Res. 144
Norm. En. per Res. -4.9861
Hub Node A(8)
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 -42.6355 -15.828 -416.31 -474.7735 135 21 7 15805 1 23 21
A-C 0.0 -12.1423 -17.9321 -30.0744 13 0 1 625 0 2 2
A-D 0.0 0.0 -2.1513 -2.1513 5 0 0 129 0 2 1
A-E -4.5017 0.0 -8.8566 -13.3583 10 3 0 431 0 1 0
A-F 0.0 0.0 -27.9873 -27.9873 16 1 0 1104 0 0 2
A-G -71.1902 -33.0425 -417.956 -522.1887 132 22 14 15957 3 22 27
A-H -36.8786 -27.6207 -160.258 -224.7573 70 14 3 6443 3 17 20
A-I -20.9781 -8.422 -123.386 -152.7861 55 3 2 4816 1 16 20
B-C -59.0105 20.1417 -528.968 -567.8368 144 51 10 19545 1 34 37
B-D -7.155 -16.2294 -19.9469 -43.3313 14 0 0 820 2 8 5
B-E -5.5 -11.5596 -20.387 -37.4466 15 6 0 847 0 4 2
B-F 0.0 0.0 -23.3463 -23.3463 18 0 0 1036 0 1 0
B-G 0.0 4.2138 -34.9049 -30.6911 17 3 2 1178 0 2 5
B-H 0.0 13.6079 -1.2881 12.3198 9 0 0 103 0 5 4
B-I -6.0931 -5.7264 -115.023 -126.8426 49 4 1 4909 0 16 19
B-J -15.9669 -35.3072 -132.967 -184.2412 49 15 2 4760 4 21 23
C-D -69.5641 -43.1133 -384.887 -497.5644 119 31 9 14613 1 28 30
C-E 0.0 0.0 -0.0923 -0.0923 3 0 0 25 0 1 0
C-J -14.2407 -14.7355 -85.1131 -114.0893 41 3 2 3871 2 17 13
C-K -26.9882 -39.4154 -57.9335 -124.3371 36 3 1 2448 8 29 24
D-E -57.6781 -40.9133 -291.495 -390.0864 117 19 7 12153 2 35 34
D-G 0.0 0.0 -0.0028 -0.0028 2 0 0 3 0 0 0
D-K -20.0981 -60.8223 -95.1034 -176.0238 53 9 1 4443 7 27 26
D-L -10.834 -37.1568 -130.308 -178.2987 52 3 0 4662 3 31 31
E-F -75.1823 -30.2835 -415.514 -520.9798 134 23 12 14984 2 31 34
E-G 0.0 0.0 -0.0025 -0.0025 2 0 0 2 0 0 0
E-L -9.6638 -18.9938 -78.0474 -106.705 42 9 0 3098 1 13 19
E-M -2.1803 -20.6778 -146.301 -169.1591 54 5 3 5308 2 29 12
F-G -87.5474 -25.4413 -417.837 -530.8257 131 18 9 15514 3 25 27
F-M -10.6675 -76.331 -99.877 -186.8755 54 12 2 4024 6 33 22
F-N -24.963 -23.5682 -97.6846 -146.2158 50 3 2 4402 3 14 10
G-H -27.8485 -84.2207 -172.327 -284.3962 61 10 1 6315 11 14 22
G-N -12.6798 -34.2844 -83.457 -130.4212 47 2 4 3691 2 13 16
G-1 -3.308 0.0 -9.8111 -13.1191 14 4 0 536 0 3 4
H-I -148.2185 -166.4687 -384.237 -698.9241 144 36 14 16100 11 44 35
H-N -31.1471 -39.4073 -92.151 -162.7055 63 2 2 3714 3 15 4
H-Y 0.0 0.0 -10.6553 -10.6553 7 0 1 541 0 0 0
H-Z -70.7878 -60.3867 -383.47 -514.6446 115 24 6 14834 4 35 39
H-1 -9.1022 -40.7253 -213.164 -262.9915 91 9 5 9268 1 22 19
I-J -13.5781 -60.3166 -120.34 -194.2347 71 6 4 5845 4 13 11
I-Y -82.106 -53.6812 -272.136 -407.9232 93 12 4 10059 4 20 20
I-Z -33.2272 -31.6888 -187.83 -252.746 74 13 1 7530 4 19 19
J-K -45.449 -33.7406 -144.083 -223.2726 71 11 3 6110 3 22 21
J-X -58.0041 -14.4029 -175.417 -247.824 57 25 2 7001 2 20 30
J-Y -33.2462 -38.7286 -206.512 -278.4868 77 14 2 7895 5 18 18
K-L -59.5723 -39.051 -175.393 -274.0164 81 9 4 6029 3 24 15
K-V 0.0 0.0 -11.1398 -11.1398 7 0 1 554 0 0 0
K-W -86.1983 -54.1113 -273.037 -413.3466 93 13 4 10119 4 20 20
K-X -33.8566 -39.2459 -204.101 -277.2036 77 15 2 7980 5 18 18
L-M -54.748 14.8734 -233.249 -273.1236 91 12 5 9523 11 28 22
L-V -67.032 -58.9932 -385.983 -512.0082 115 29 6 15067 4 35 39
L-W -33.3392 -31.7789 -188.007 -253.1252 74 14 1 7462 4 19 19
M-N -13.9861 -22.0566 -135.685 -171.7277 64 10 1 6073 2 22 14
M-U 0.0 0.0 -11.0172 -11.0172 13 3 0 525 0 3 4
M-V -12.5015 -41.7789 -211.889 -266.1694 91 10 5 9263 1 22 19
M-2 -128.4836 27.0148 -403.457 -504.9258 114 27 11 14514 4 29 31
N-1 -126.3916 26.9831 -407.846 -507.2545 114 26 11 14518 4 29 31
N-2 -43.2275 -17.2357 -167.507 -227.9702 56 20 3 6773 4 10 11
O-P -54.6655 -17.2602 -433.122 -505.0477 137 30 7 16218 1 23 22
O-Q 0.0 -12.8336 -19.9737 -32.8073 13 0 1 667 0 2 2
O-R 0.0 0.0 -2.5713 -2.5713 5 0 0 148 0 2 1
O-S -4.1282 0.0 -10.4711 -14.5993 10 3 0 415 0 1 0
O-T 0.0 0.0 -26.4364 -26.4364 16 1 0 1063 0 0 1
O-U -78.262 -33.5535 -435.641 -547.4564 132 25 14 16425 3 22 28
O-V -39.9153 -27.393 -158.654 -225.9623 69 16 3 6538 4 17 20
O-W -17.0745 1.4793 -121.103 -136.6981 54 2 2 4827 1 16 20
P-Q -38.377 10.002 -458.455 -486.83 138 29 7 18132 1 33 37
P-R -7.6066 -16.5501 -26.2311 -50.3877 14 2 0 890 2 8 6
P-S -4.3261 -10.7492 -20.9501 -36.0254 13 2 0 794 0 4 2
P-T 0.0 0.0 -21.8091 -21.8091 18 0 0 996 0 1 0
P-U 0.0 4.4509 -40.0179 -35.5669 17 2 2 1256 0 2 5
P-V 0.0 13.4794 -1.5094 11.97 10 0 0 116 0 5 4
P-W -2.7654 -5.5508 -109.901 -118.2172 51 6 0 4837 0 17 19
P-X -15.8506 -34.5471 -135.149 -185.5467 50 18 3 4855 4 21 23
Q-R -64.9034 -36.791 -371.211 -472.9055 119 29 9 14601 1 27 30
Q-S 0.0 0.0 -0.0868 -0.0868 3 0 0 25 0 1 0
Q-X -13.9796 -14.6561 -85.0083 -113.644 43 3 2 3832 2 17 13
Q-Y -27.5171 -38.3756 -54.9767 -120.8694 36 2 1 2377 8 30 24
R-S -59.5212 -41.7134 -321.333 -422.5676 117 25 7 12574 2 35 36
R-U 0.0 0.0 -0.0062 -0.0062 2 0 0 4 0 0 0
R-Y -15.5217 -60.9218 -95.4204 -171.864 51 9 1 4369 6 27 26
R-Z -9.2426 -37.2469 -134.925 -181.4146 53 3 0 4732 3 31 31
S-T -75.4437 -29.8774 -421.956 -527.277 134 23 12 15220 2 31 34
S-U 0.0 0.0 -0.002 -0.002 2 0 0 2 0 0 0
S-Z -13.0385 -19.6123 -79.1194 -111.7703 44 9 0 3144 1 13 19
S-1 0.0 -21.0564 -146.594 -167.6504 54 6 3 5311 2 29 12
T-U -80.2916 -25.1487 -417.181 -522.6213 132 18 9 15415 4 26 27
T-1 -11.3889 -76.3444 -100.038 -187.7713 53 12 2 4013 6 33 22
T-2 -24.2142 -24.4433 -99.5204 -148.1779 50 2 2 4438 3 14 10
U-V -27.1016 -78.4868 -171.361 -276.9494 60 8 1 6104 11 14 21
U-2 -10.144 -32.1675 -85.0 -127.3116 48 6 4 3703 1 13 15
V-W -147.5431 -166.4745 -403.976 -717.9936 144 32 14 16166 11 44 35
V-2 -29.8684 -38.5984 -90.9294 -159.3962 64 2 2 3699 3 15 4
W-X -11.7816 -59.5365 -120.987 -192.3051 71 7 4 5773 4 13 11
X-Y -48.3501 -34.1088 -144.196 -226.6549 71 12 3 6194 3 21 21
Y-Z -58.5869 -38.362 -176.104 -273.0529 81 9 4 6032 3 24 15
Z-1 -59.0433 14.1614 -230.935 -275.8169 91 17 5 9623 11 28 23
1-2 -13.7044 -21.855 -136.978 -172.5374 64 7 1 6040 2 22 14