| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
E |
140 |
39 |
10040 |
◊ |
D |
x,y,z |
1_555 |
150 |
38 |
9785 |
1438.8 |
-22.0 |
0.055 |
9 |
0 |
0 |
0.134 |
2 |
|
A |
137 |
36 |
10714 |
◊ |
B |
x,y,z |
1_555 |
144 |
41 |
9631 |
1372.4 |
-23.0 |
0.043 |
2 |
3 |
0 |
0.114 |
3 |
|
A |
89 |
22 |
10714 |
◊ |
A |
y,x,-z |
7_555 |
87 |
22 |
10714 |
908.7 |
-14.3 |
0.069 |
2 |
0 |
0 |
0.054 |
4 |
|
B |
89 |
27 |
9631 |
◊ |
D |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
89 |
24 |
9785 |
847.0 |
-5.6 |
0.685 |
2 |
0 |
0 |
0.048 |
5 |
|
A |
58 |
14 |
10714 |
◊ |
E |
y,x,-z |
7_555 |
57 |
16 |
10040 |
534.3 |
-2.1 |
0.645 |
2 |
1 |
0 |
0.011 |
6 |
|
[RHQ]A:201 |
32 |
1 |
691 |
cf |
A |
x,y,z |
1_555 |
68 |
18 |
10714 |
458.7 |
3.4 |
0.580 |
2 |
0 |
0 |
0.000 |
7 |
|
A |
43 |
11 |
10714 |
◊ |
E |
x,y,z |
1_555 |
54 |
16 |
10040 |
414.0 |
-2.8 |
0.543 |
4 |
0 |
0 |
0.017 |
8 |
|
D |
21 |
7 |
9785 |
◊ |
D |
y,x,-z+1 |
7_556 |
21 |
7 |
9785 |
218.1 |
-3.9 |
0.210 |
0 |
0 |
0 |
0.010 |
9 |
|
E |
23 |
6 |
10040 |
◊ |
E |
y,x,-z+1 |
7_556 |
23 |
6 |
10040 |
178.0 |
-3.6 |
0.241 |
0 |
0 |
0 |
0.016 |
10 |
|
D |
17 |
6 |
9785 |
◊ |
B |
-y-1/2,x+1/2,z+1/2 |
3_455 |
14 |
9 |
9631 |
118.4 |
-2.6 |
0.283 |
0 |
0 |
0 |
0.008 |
11 |
|
[SO4]B:507 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
9631 |
100.4 |
-16.8 |
0.751 |
2 |
0 |
0 |
0.132 |
12 |
|
[SO4]B:508 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
9631 |
88.4 |
-13.7 |
0.829 |
5 |
0 |
0 |
0.119 |
13 |
|
[SO4]A:506 |
5 |
1 |
185 |
f |
E |
y,x,-z |
7_555 |
15 |
5 |
10040 |
88.2 |
-10.7 |
0.897 |
5 |
0 |
0 |
0.117 |
14 |
|
[SO4]E:517 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
11 |
5 |
10040 |
87.8 |
-13.5 |
0.637 |
3 |
0 |
0 |
0.134 |
15 |
|
[SO4]A:503 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
10714 |
87.0 |
-14.0 |
0.587 |
5 |
0 |
0 |
0.115 |
16 |
|
[SO4]E:516 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
14 |
5 |
10040 |
86.5 |
-13.7 |
0.688 |
3 |
0 |
0 |
0.136 |
17 |
|
[SO4]A:512 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
10714 |
86.3 |
-13.0 |
0.785 |
5 |
0 |
0 |
0.107 |
18 |
|
[SO4]D:509 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
9785 |
84.8 |
-13.5 |
0.696 |
2 |
0 |
0 |
0.108 |
19 |
|
[SO4]E:514 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
14 |
5 |
10040 |
83.6 |
-12.5 |
0.746 |
3 |
0 |
0 |
0.125 |
20 |
|
[SO4]E:512 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
10 |
5 |
10040 |
83.5 |
-11.4 |
0.874 |
4 |
0 |
0 |
0.119 |
21 |
|
[SO4]D:502 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
9785 |
83.1 |
-12.7 |
0.781 |
3 |
0 |
0 |
0.106 |
22 |
|
B |
12 |
3 |
9631 |
◊ |
B |
y,x,-z |
7_555 |
13 |
3 |
9631 |
81.0 |
-1.2 |
0.501 |
0 |
0 |
0 |
0.003 |
23 |
|
[SO4]A:515 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
10714 |
80.0 |
-11.1 |
0.611 |
1 |
0 |
0 |
0.081 |
24 |
|
[SO4]A:501 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
10714 |
79.9 |
-9.9 |
0.877 |
3 |
0 |
0 |
0.079 |
25 |
|
[SO4]A:517 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
10714 |
79.6 |
-12.5 |
0.716 |
3 |
0 |
0 |
0.098 |
26 |
|
[SO4]B:505 |
5 |
1 |
185 |
f |
D |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
21 |
5 |
9785 |
79.2 |
-12.4 |
0.837 |
2 |
0 |
0 |
0.099 |
27 |
|
[SO4]E:515 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
11 |
4 |
10040 |
75.6 |
-10.0 |
0.815 |
2 |
0 |
0 |
0.098 |
28 |
|
[SO4]A:516 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
10714 |
73.8 |
-11.5 |
0.585 |
2 |
0 |
0 |
0.087 |
29 |
|
[SO4]E:513 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
8 |
5 |
10040 |
71.1 |
-9.7 |
0.876 |
2 |
0 |
0 |
0.096 |
30 |
|
[SO4]A:507 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
10714 |
70.5 |
-8.5 |
0.882 |
2 |
0 |
0 |
0.066 |
31 |
|
[SO4]A:513 |
4 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
11 |
4 |
10040 |
70.2 |
-10.3 |
0.701 |
0 |
0 |
0 |
0.094 |
32 |
|
[SO4]A:504 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
10714 |
68.9 |
-7.9 |
0.915 |
3 |
0 |
0 |
0.065 |
33 |
|
[SO4]A:514 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
10714 |
65.3 |
-9.2 |
0.672 |
1 |
0 |
0 |
0.068 |
34 |
|
[SO4]D:516 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
9785 |
63.9 |
-7.5 |
0.876 |
3 |
0 |
0 |
0.066 |
35 |
|
B |
10 |
5 |
9631 |
f |
[SO4]D:508 |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
5 |
1 |
184 |
63.9 |
-8.7 |
0.881 |
4 |
0 |
0 |
0.078 |
36 |
|
[SO4]A:513 |
5 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
10714 |
63.2 |
-9.0 |
0.589 |
0 |
0 |
0 |
0.034 |
37 |
|
[SO4]A:501 |
4 |
1 |
185 |
◊ |
E |
x,y,z |
1_555 |
10 |
4 |
10040 |
60.0 |
-6.8 |
0.884 |
3 |
0 |
0 |
0.031 |
38 |
|
[SO4]B:506 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
9631 |
56.3 |
-6.8 |
0.893 |
1 |
0 |
0 |
0.054 |
39 |
|
[SO4]A:511 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
10714 |
55.0 |
-6.5 |
0.820 |
1 |
0 |
0 |
0.049 |
40 |
|
[SO4]D:508 |
5 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
9785 |
51.9 |
-7.3 |
0.906 |
4 |
0 |
0 |
0.068 |
41 |
|
[SO4]E:516 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
9785 |
51.8 |
-6.3 |
0.791 |
1 |
0 |
0 |
0.035 |
42 |
|
[SO4]E:517 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
9785 |
43.6 |
-5.1 |
0.842 |
1 |
0 |
0 |
0.028 |
43 |
|
B |
3 |
3 |
9631 |
◊ |
B |
-x-1,-y-1,z |
2_445 |
3 |
3 |
9631 |
41.4 |
-1.1 |
0.169 |
0 |
0 |
0 |
0.002 |
44 |
|
[SO4]B:505 |
4 |
1 |
185 |
◊ |
[SO4]D:508 |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
4 |
1 |
184 |
40.2 |
-9.1 |
0.998 |
0 |
0 |
0 |
0.068 |
45 |
|
[SO4]D:509 |
3 |
1 |
185 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
10040 |
39.4 |
-4.5 |
0.831 |
0 |
0 |
0 |
0.023 |
46 |
|
[SO4]B:505 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
9631 |
38.8 |
-3.8 |
0.943 |
2 |
0 |
0 |
0.035 |
47 |
|
[SO4]A:504 |
3 |
1 |
185 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
10040 |
37.8 |
-4.8 |
0.531 |
0 |
0 |
0 |
0.018 |
48 |
|
[SO4]B:507 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
10714 |
36.4 |
-4.3 |
0.707 |
1 |
0 |
0 |
0.022 |
49 |
|
[SO4]A:515 |
4 |
1 |
185 |
f |
[SO4]A:514 |
x,y,z |
1_555 |
3 |
1 |
185 |
31.5 |
-7.1 |
0.995 |
0 |
0 |
0 |
0.050 |
50 |
|
[SO4]E:514 |
3 |
1 |
185 |
◊ |
E |
y,x,-z+1 |
7_556 |
5 |
3 |
10040 |
30.1 |
-3.8 |
0.837 |
0 |
0 |
0 |
0.035 |
51 |
|
[SO4]A:504 |
3 |
1 |
185 |
f |
[SO4]A:503 |
x,y,z |
1_555 |
3 |
1 |
185 |
22.9 |
-5.4 |
0.992 |
0 |
0 |
0 |
0.038 |
52 |
|
[SO4]A:506 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
10714 |
20.9 |
-2.0 |
0.933 |
0 |
0 |
0 |
0.007 |
53 |
|
[SO4]A:517 |
1 |
1 |
184 |
f |
[SO4]A:514 |
x,y,z |
1_555 |
2 |
1 |
185 |
16.1 |
-3.9 |
0.876 |
0 |
0 |
0 |
0.027 |
54 |
|
[SO4]A:511 |
2 |
1 |
186 |
◊ |
A |
y,x,-z |
7_555 |
5 |
2 |
10714 |
14.8 |
-1.7 |
0.834 |
0 |
0 |
0 |
0.012 |
55 |
|
[SO4]A:514 |
3 |
1 |
185 |
◊ |
A |
y,x,-z |
7_555 |
2 |
1 |
10714 |
13.6 |
-1.8 |
0.571 |
0 |
0 |
0 |
0.013 |
56 |
|
[SO4]E:514 |
2 |
1 |
185 |
◊ |
[SO4]E:512 |
y,x,-z+1 |
7_556 |
1 |
1 |
185 |
10.2 |
-2.4 |
0.876 |
0 |
0 |
0 |
0.021 |
57 |
|
[SO4]A:511 |
1 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
10040 |
9.5 |
-1.3 |
0.430 |
0 |
0 |
0 |
0.005 |
58 |
|
[SO4]B:508 |
1 |
1 |
185 |
f |
[SO4]B:506 |
x,y,z |
1_555 |
1 |
1 |
185 |
9.1 |
-2.2 |
0.800 |
0 |
0 |
0 |
0.016 |
59 |
|
[SO4]A:503 |
3 |
1 |
185 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
10040 |
9.0 |
-0.8 |
0.918 |
0 |
0 |
0 |
0.003 |
60 |
|
[SO4]A:512 |
1 |
1 |
184 |
f |
[SO4]A:507 |
x,y,z |
1_555 |
1 |
1 |
185 |
5.8 |
-1.4 |
0.800 |
0 |
0 |
0 |
0.010 |
61 |
|
[SO4]E:514 |
2 |
1 |
185 |
◊ |
[SO4]E:514 |
y,x,-z+1 |
7_556 |
1 |
1 |
185 |
5.0 |
-1.2 |
0.876 |
0 |
0 |
0 |
0.005 |
62 |
|
A |
1 |
1 |
10714 |
◊ |
B |
y,x,-z |
7_555 |
1 |
1 |
9631 |
4.9 |
0.1 |
0.555 |
0 |
0 |
0 |
0.000 |
63 |
|
B |
1 |
1 |
9631 |
◊ |
E |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
2 |
1 |
10040 |
4.7 |
-0.0 |
0.504 |
0 |
0 |
0 |
0.000 |
64 |
|
[SO4]E:512 |
1 |
1 |
185 |
◊ |
E |
y,x,-z+1 |
7_556 |
1 |
1 |
10040 |
3.5 |
-0.5 |
0.653 |
0 |
0 |
0 |
0.005 |
65 |
|
A |
1 |
1 |
10714 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
9785 |
2.2 |
0.1 |
0.762 |
0 |
0 |
0 |
0.000 |
66 |
|
[SO4]A:515 |
1 |
1 |
185 |
◊ |
[SO4]A:513 |
x,y,z |
1_555 |
1 |
1 |
186 |
2.0 |
-0.5 |
1.000 |
0 |
0 |
0 |
0.002 |
|