2G82
high resolution structures of thermus aquaticus glyceraldehyde-3- phosphate dehydrogenase: role of 220's loop motion in catalysis
Total interactions analyzed 28
Total true interactions 17
Strongest Interaction Chains R-C
Int. Res. 22
Norm. En. per Res. -5.63
Hub Node O(4)
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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.
O-P -148.3678 -109.6827 -640.043 -898.0935 183 19 20 26705 20 58 39
O-Q -33.3999 -40.4832 -116.947 -190.8301 54 3 2 4301 1 46 21
O-R -33.5572 -31.146 -377.818 -442.5212 126 10 14 15791 2 40 54
O-D -8.6513 -10.2824 -6.4511 -25.3848 14 1 0 318 2 22 16
P-Q -42.035 -31.2314 -374.721 -447.9874 128 9 14 15653 2 41 55
P-R -20.639 -25.7783 -109.833 -156.2503 54 2 2 4131 0 46 21
Q-R -164.1512 -105.0066 -632.194 -901.3519 183 17 19 26585 20 58 38
Q-C 0.0 11.1879 -4.7353 6.4526 13 0 0 251 0 4 3
Q-D -27.7185 -62.9565 -34.8498 -125.5247 23 4 0 1480 4 15 12
R-A -15.2821 -14.4584 -4.391 -34.1315 11 1 0 186 2 18 10
R-C -26.964 -60.5775 -36.3191 -123.8606 22 2 0 1390 4 15 10
A-B -159.0339 -104.4029 -620.422 -883.8588 182 20 19 26342 20 58 38
A-C -21.147 -36.6992 -116.835 -174.6812 54 2 2 4286 1 46 21
A-D -40.9344 -31.0632 -373.095 -445.0925 127 7 14 15487 2 40 54
B-C -41.218 -30.7555 -376.343 -448.3165 126 7 14 15722 2 40 55
B-D -25.9129 -25.6658 -115.307 -166.8857 53 3 2 4195 0 46 21
C-D -140.9293 -103.5372 -620.554 -865.0205 182 16 19 26291 20 58 38