4A34
crystal structure of the fucose mutarotase in complex with l-fucose from streptococcus pneumoniae
Total interactions analyzed 190
Total true interactions 44
Strongest Interaction Chains N-S
Int. Res. 72
Norm. En. per Res. -4.4445
Hub Node B(5)
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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 -24.8719 5.5019 -94.5362 -113.9062 55 3 0 3790 0 15 15
A-E -26.7673 5.4561 -95.9737 -117.2849 53 4 2 3692 0 14 13
A-F -30.1636 -0.4847 -280.719 -311.3672 75 7 7 11503 0 15 20
A-J 0.0 -0.1136 -41.9563 -42.0699 48 0 0 2370 0 12 11
B-C -29.7166 3.165 -94.9636 -121.5152 54 5 2 3762 0 14 12
B-F 0.0 3.373 -40.9443 -37.5713 44 1 0 2032 0 12 11
B-G -35.0019 -4.8522 -274.179 -314.0331 71 11 9 11384 1 16 22
B-O 0.0 0.0 -0.0692 -0.0692 3 0 0 9 0 3 4
B-S 0.0 -8.1809 -31.6026 -39.7835 33 1 0 1266 1 12 12
C-D -27.9501 3.3008 -107.911 -132.5603 55 4 2 4127 1 14 12
C-G 0.0 0.0835 -34.6502 -34.5667 45 0 0 1973 0 12 11
C-H -31.3643 4.5873 -274.941 -301.718 72 9 8 11399 0 16 20
D-E -29.7018 2.6088 -81.4906 -108.5836 50 8 1 3554 0 14 11
D-H 0.0 0.11 -39.4501 -39.3401 45 0 0 2059 0 12 11
D-I -32.4646 1.3428 -287.157 -318.2788 73 6 9 11728 0 19 22
E-I 0.0 0.9313 -39.2584 -38.3271 46 0 0 2174 0 12 11
E-J -35.6111 0.0021 -256.936 -292.545 67 9 8 10546 0 16 19
F-G -21.9654 4.9635 -92.3066 -109.3085 54 6 1 3789 0 14 13
F-J -28.6513 5.0157 -92.3296 -115.9652 54 8 1 3579 0 15 14
F-S 0.0 0.0 -0.0046 -0.0046 3 0 0 6 0 2 2
G-H -22.9895 3.755 -98.2425 -117.477 55 2 2 3909 0 13 12
G-S 0.0 -7.4164 -4.7677 -12.1841 20 0 0 436 0 8 6
H-I -33.8333 5.2559 -102.729 -131.3064 58 6 2 4244 0 15 16
I-J -33.7251 3.5823 -99.0999 -129.2427 58 6 1 4066 0 14 13
K-L -35.1452 -3.2281 -96.7424 -135.1157 56 3 3 3938 0 14 12
K-O -24.1093 -0.186 -101.563 -125.8583 55 4 3 3920 0 14 11
K-P -41.0956 4.6392 -275.556 -312.0124 71 9 7 10758 0 16 21
K-T 0.0 4.2837 -37.8211 -33.5374 45 0 0 1980 0 12 11
L-M -33.0896 5.9513 -97.0761 -124.2144 56 6 2 3968 0 13 12
L-P 0.0 1.294 -44.8565 -43.5625 47 2 0 2309 0 12 11
L-Q -31.0379 -2.5517 -277.096 -310.6856 72 13 9 11745 1 16 21
M-N -31.1525 0.3543 -98.1343 -128.9325 57 4 3 3953 0 14 12
M-Q 0.0 2.2265 -39.742 -37.5155 47 0 0 2218 0 12 11
M-R -22.2335 1.0385 -282.11 -303.305 71 7 9 11416 0 15 21
N-O -24.7436 8.0502 -89.734 -106.4275 54 11 2 3616 0 13 11
N-R 0.0 -1.4152 -38.5656 -39.9808 44 0 0 2092 0 12 11
N-S -30.8754 -0.8306 -288.298 -320.004 72 14 9 12210 0 16 19
O-S 0.0 2.3958 -42.2025 -39.8067 46 0 0 2356 0 12 11
O-T -22.515 1.9157 -275.327 -295.9263 72 8 9 11343 0 16 21
P-Q -26.2988 3.7392 -98.9248 -121.4844 53 4 2 3849 0 14 13
P-T -25.2901 -1.7799 -81.9884 -109.0585 53 4 0 3466 0 14 11
Q-R -25.4352 3.3335 -94.3492 -116.4509 57 4 1 3754 0 14 11
R-S -33.6166 3.7111 -104.249 -134.1545 57 10 2 4012 0 14 12
S-T -20.522 1.5832 -94.2636 -113.2024 54 4 2 3940 0 13 11