2FHH
crystal structure of mycobacterium tuberculosis proteasome in complex with a peptidyl boronate inhibitor mln-273
Total interactions analyzed 378
Total true interactions 70
Strongest Interaction Chains M-N
Int. Res. 63
Norm. En. per Res. -4.9812
Hub Node G(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
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-H -46.0546 -88.6332 -143.601 -278.2888 59 15 2 5829 15 37 37
A-B -18.5849 -18.9544 -166.283 -203.8223 90 10 3 7340 3 25 27
A-O -6.7611 -11.3253 -114.806 -132.8924 83 8 1 6108 2 23 23
A-P -30.6194 -28.3356 -78.196 -137.151 39 2 1 3587 2 17 19
H-B -26.2735 -32.5833 -88.457 -147.3138 40 3 1 3602 2 18 20
H-C 0.0 -13.9759 -40.1368 -54.1127 56 0 2 2442 2 18 12
H-E -42.1453 -99.4165 -99.304 -240.8658 57 14 1 4734 8 28 24
H-L -40.1889 -100.8092 -174.405 -315.4031 77 11 2 6697 9 25 17
H-P 0.0 -8.3377 -42.4679 -50.8056 58 2 2 2511 1 15 12
B-C -51.4925 -75.2579 -153.742 -280.4924 59 4 2 5777 13 37 36
B-I -11.9126 -17.2783 -163.596 -192.7869 87 6 2 7241 4 25 27
C-E -47.13 -83.2832 -165.434 -295.8472 79 7 2 6416 8 24 16
C-I -42.3815 -32.9586 -101.67 -177.0101 42 7 1 4038 2 19 25
C-J 0.0 -12.6697 -44.4073 -57.077 58 1 2 2542 2 16 12
C-R -40.2948 -98.5275 -102.322 -241.1443 58 14 1 4802 11 28 24
D-E -44.681 -71.6201 -139.522 -255.8231 58 13 3 5686 14 37 36
D-K -15.004 -19.5755 -151.009 -185.5885 84 8 2 6864 4 23 24
D-Q -16.9706 -0.8176 -148.289 -166.0772 84 10 1 6723 1 23 25
D-R -28.984 -3.3398 -73.6533 -105.9771 41 4 1 3175 1 16 18
E-K -32.6895 -23.2429 -84.2363 -140.1687 43 8 1 3623 2 17 19
E-L -8.0297 -24.5804 -39.4916 -72.1017 57 4 2 2547 4 17 12
E-R 0.0 -20.327 -39.1122 -59.4392 56 2 2 2457 2 15 12
F-G -58.4365 -73.0959 -156.551 -288.0834 60 11 3 5941 14 38 36
F-M -19.2316 -21.9521 -154.064 -195.2477 86 15 2 7021 4 25 26
F-N -32.2827 -37.3882 -95.1392 -164.8101 44 6 1 3746 2 19 22
F-W -33.2092 -14.2108 -159.519 -206.939 87 15 2 7274 4 25 28
G-N 0.0 -16.011 -42.7804 -58.7914 57 1 2 2507 1 17 12
G-V -45.0914 -77.2869 -181.172 -303.5504 81 9 2 6652 6 26 17
G-W -30.6751 -35.0995 -93.8332 -159.6078 44 9 1 3738 2 19 23
G-X -4.4825 -22.9159 -47.4554 -74.8538 57 0 2 2605 4 17 12
G-2 -56.7391 -102.3861 -83.2836 -242.4088 57 22 1 4705 7 28 24
I-J -50.3627 -86.0445 -148.129 -284.5363 61 10 2 5832 13 39 37
I-S -17.878 -14.8515 -163.6 -196.3295 90 10 2 7221 3 25 28
J-R -34.2654 -97.8438 -156.974 -289.0831 79 9 2 6417 8 24 17
J-S -35.2244 -21.983 -96.2329 -153.4403 43 7 1 3838 1 19 22
J-T -10.055 -17.6594 -44.7613 -72.4757 57 2 2 2539 2 15 11
J-Z -40.6163 -98.6499 -90.6275 -229.8936 57 15 1 4873 10 28 24
K-L -52.7662 -80.2349 -172.449 -305.4501 62 11 2 6188 14 40 37
K-M -11.5931 -8.7451 -156.106 -176.4442 84 18 1 7232 1 24 27
L-M -18.8499 -5.1644 -96.9592 -120.9734 42 6 1 3749 1 19 22
L-N -7.2508 -29.2679 -35.6591 -72.1778 57 4 2 2503 3 15 12
L-P -41.5065 -101.0411 -83.1052 -225.6528 57 16 1 4747 8 28 24
M-N -68.3655 -84.4592 -160.992 -313.8167 63 14 3 6172 12 41 37
N-P -42.0642 -83.4748 -178.834 -304.373 82 6 2 6579 10 26 17
N-V -41.0878 -100.0436 -91.7944 -232.9258 57 11 1 4717 10 28 24
O-P -48.736 -80.471 -140.859 -270.066 57 17 3 5774 12 36 36
O-U -13.8957 -16.4584 -149.583 -179.9371 86 9 2 7018 1 24 26
O-V -26.4447 -31.0158 -96.6954 -154.156 45 5 1 3786 2 19 21
P-V 0.0 -12.3667 -40.6541 -53.0208 57 0 2 2377 2 15 12
Q-R -41.2049 -28.0142 -140.825 -210.0441 58 11 3 5687 12 37 36
Q-Y -10.1292 -17.0319 -159.394 -186.5551 84 10 1 7225 1 26 27
Q-Z -28.7286 -30.544 -56.6623 -115.9349 43 7 1 3644 1 18 18
R-Z 0.0 -10.3368 -37.5178 -47.8546 56 0 2 2350 1 16 12
S-T -51.7327 -67.9562 -155.072 -274.7609 59 12 3 5758 13 37 36
S-1 -10.5626 -31.1101 -151.938 -193.6107 84 7 2 6621 5 24 25
T-X -43.4386 -98.9634 -103.566 -245.968 58 14 1 4676 8 28 22
T-Z -34.5835 -85.0164 -176.655 -296.2549 78 6 2 6384 8 25 17
T-1 -16.5016 -30.0159 -93.9085 -140.4261 42 5 1 3797 2 18 21
T-2 -15.612 -32.7051 -45.0643 -93.3815 58 2 2 2439 4 15 12
U-V -51.249 -62.2526 -153.678 -267.1797 59 12 2 5705 11 37 36
U-1 -12.3323 -14.9311 -163.724 -190.9874 86 10 2 7190 3 25 27
U-2 -30.14 -28.5624 -108.01 -166.7123 44 5 1 3954 2 19 24
V-2 -11.4069 -18.6048 -42.7658 -72.7776 58 2 2 2519 1 17 12
W-X -49.9558 -46.4664 -136.379 -232.8012 56 10 2 5501 13 36 34
W-Y -12.3403 -9.5668 -130.091 -151.9981 82 9 2 6634 1 23 24
X-Y -9.6204 -30.737 -90.0868 -130.4442 42 6 1 3644 2 19 21
X-Z 0.0 -7.2914 -41.2535 -48.5449 55 0 2 2474 1 17 12
X-2 -53.4744 -123.0254 -173.714 -350.2138 80 10 2 6528 10 26 17
Y-Z -47.009 -68.4851 -123.101 -238.5951 59 18 2 5836 13 37 36
1-2 -39.9052 -53.6418 -143.72 -237.267 58 11 2 5459 12 37 34