| ## |
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 |
|
B |
109 |
31 |
13603 |
◊ |
A |
x,y,z |
1_555 |
102 |
32 |
14073 |
1001.4 |
-6.5 |
0.185 |
11 |
0 |
0 |
0.078 |
2 |
|
A |
78 |
21 |
14073 |
◊ |
B |
-x+3/2,-y+1,z-1/2 |
2_664 |
75 |
22 |
13603 |
699.1 |
-5.0 |
0.210 |
6 |
2 |
0 |
0.062 |
3 |
|
B |
44 |
13 |
13603 |
◊ |
A |
-x+2,y-1/2,-z+3/2 |
3_746 |
35 |
10 |
14073 |
404.8 |
-4.9 |
0.117 |
2 |
0 |
0 |
0.000 |
4 |
|
A |
33 |
14 |
14073 |
x |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
39 |
13 |
14073 |
305.4 |
0.1 |
0.601 |
2 |
3 |
0 |
0.000 |
5 |
|
A |
33 |
8 |
14073 |
x |
A |
-x+2,y-1/2,-z+3/2 |
3_746 |
34 |
9 |
14073 |
272.9 |
1.8 |
0.721 |
3 |
0 |
0 |
0.000 |
6 |
|
B |
27 |
10 |
13603 |
◊ |
A |
-x+1,y-1/2,-z+3/2 |
3_646 |
31 |
10 |
14073 |
248.0 |
1.3 |
0.668 |
4 |
2 |
0 |
0.000 |
7 |
|
B |
22 |
6 |
13603 |
x |
B |
-x+1,y-1/2,-z+3/2 |
3_646 |
16 |
5 |
13603 |
147.8 |
-0.9 |
0.372 |
1 |
0 |
0 |
0.000 |
8 |
|
B |
14 |
6 |
13603 |
◊ |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
17 |
6 |
14073 |
124.0 |
0.7 |
0.664 |
0 |
0 |
0 |
0.000 |
9 |
|
[SO4]A:750 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
14073 |
113.1 |
-17.9 |
0.637 |
7 |
0 |
0 |
0.162 |
10 |
|
[SO4]B:751 |
5 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
13603 |
109.8 |
-17.4 |
0.641 |
8 |
0 |
0 |
0.162 |
11 |
|
[EDO]B:903 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
13603 |
94.7 |
3.1 |
0.470 |
2 |
0 |
0 |
0.000 |
12 |
|
[EDO]B:904 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
13603 |
94.5 |
2.9 |
0.466 |
3 |
0 |
0 |
0.000 |
13 |
|
[EDO]A:907 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
14 |
8 |
14073 |
93.6 |
2.4 |
0.248 |
1 |
0 |
0 |
0.000 |
14 |
|
[EDO]A:908 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
19 |
5 |
14073 |
93.1 |
2.7 |
0.444 |
2 |
0 |
0 |
0.000 |
15 |
|
[EDO]A:900 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
13603 |
86.3 |
1.6 |
0.201 |
1 |
0 |
0 |
0.000 |
16 |
|
[EDO]A:906 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
14073 |
82.8 |
2.8 |
0.316 |
1 |
0 |
0 |
0.000 |
17 |
|
[SO4]A:755 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
14073 |
81.5 |
-10.7 |
0.819 |
4 |
0 |
0 |
0.097 |
18 |
|
A |
10 |
4 |
14073 |
f |
[SO4]B:756 |
-x+3/2,-y+1,z-1/2 |
2_664 |
5 |
1 |
184 |
77.4 |
-10.2 |
0.884 |
4 |
0 |
0 |
0.093 |
19 |
|
[EDO]A:905 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
14073 |
77.3 |
2.2 |
0.281 |
2 |
0 |
0 |
0.000 |
20 |
|
[SO4]B:758 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
13603 |
74.9 |
-10.3 |
0.785 |
3 |
0 |
0 |
0.090 |
21 |
|
[EDO]A:900 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
14073 |
73.8 |
1.3 |
0.216 |
0 |
0 |
0 |
0.000 |
22 |
|
[SO4]A:752 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
14073 |
72.0 |
-10.3 |
0.523 |
3 |
0 |
0 |
0.090 |
23 |
|
[SO4]A:753 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
13603 |
71.4 |
-9.2 |
0.818 |
4 |
0 |
0 |
0.085 |
24 |
|
[SO4]A:755 |
5 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
13603 |
69.2 |
-9.5 |
0.675 |
2 |
0 |
0 |
0.071 |
25 |
|
[SO4]A:753 |
5 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
14073 |
68.8 |
-8.7 |
0.798 |
2 |
0 |
0 |
0.066 |
26 |
|
[SO4]A:757 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
14073 |
64.5 |
-7.7 |
0.838 |
2 |
0 |
0 |
0.066 |
27 |
|
[SO4]B:759 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
13603 |
61.9 |
-7.6 |
0.798 |
2 |
0 |
0 |
0.066 |
28 |
|
[EDO]A:901 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
14073 |
61.4 |
2.6 |
0.946 |
1 |
0 |
0 |
0.000 |
29 |
|
[EDO]A:901 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
13603 |
58.4 |
0.7 |
0.573 |
3 |
0 |
0 |
0.005 |
30 |
|
[SO4]A:757 |
4 |
1 |
186 |
◊ |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
4 |
2 |
14073 |
53.0 |
-6.3 |
0.768 |
0 |
0 |
0 |
0.000 |
31 |
|
[SO4]A:757 |
4 |
1 |
186 |
◊ |
B |
-x+3/2,-y+1,z-1/2 |
2_664 |
6 |
2 |
13603 |
51.8 |
-5.7 |
0.925 |
2 |
0 |
0 |
0.051 |
32 |
|
[SO4]A:752 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
13603 |
46.9 |
-4.2 |
0.966 |
2 |
0 |
0 |
0.035 |
33 |
|
[EDO]B:902 |
3 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
13603 |
38.5 |
1.1 |
0.725 |
0 |
0 |
0 |
0.000 |
34 |
|
[SO4]B:756 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
13603 |
32.1 |
-2.2 |
0.974 |
2 |
0 |
0 |
0.024 |
35 |
|
B |
5 |
3 |
13603 |
x |
B |
-x+3/2,-y+1,z-1/2 |
2_664 |
3 |
1 |
13603 |
31.7 |
-0.1 |
0.315 |
0 |
0 |
0 |
0.000 |
36 |
|
[EDO]A:908 |
3 |
1 |
183 |
f |
[EDO]A:906 |
x,y,z |
1_555 |
3 |
1 |
184 |
30.3 |
1.2 |
1.000 |
1 |
0 |
0 |
0.000 |
37 |
|
[EDO]A:908 |
2 |
1 |
183 |
f |
A |
-x+2,y-1/2,-z+3/2 |
3_746 |
2 |
1 |
14073 |
24.7 |
0.5 |
0.914 |
1 |
0 |
0 |
0.000 |
38 |
|
[SO4]A:753 |
4 |
1 |
183 |
◊ |
B |
-x+3/2,-y+1,z-1/2 |
2_664 |
2 |
1 |
13603 |
18.9 |
-2.6 |
0.222 |
0 |
0 |
0 |
0.000 |
39 |
|
[SO4]B:759 |
3 |
1 |
186 |
f |
[SO4]B:758 |
x,y,z |
1_555 |
1 |
1 |
187 |
8.8 |
-2.0 |
0.891 |
0 |
0 |
0 |
0.016 |
40 |
|
B |
1 |
1 |
13603 |
◊ |
[EDO]A:901 |
-x+1,y-1/2,-z+3/2 |
3_646 |
2 |
1 |
185 |
7.4 |
0.3 |
0.908 |
0 |
0 |
0 |
0.000 |
41 |
|
[EDO]A:908 |
1 |
1 |
183 |
f |
[EDO]A:907 |
x,y,z |
1_555 |
1 |
1 |
185 |
7.0 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
42 |
|
[SO4]B:751 |
1 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
14073 |
4.7 |
-0.6 |
0.645 |
0 |
0 |
0 |
0.004 |
43 |
|
[EDO]A:907 |
2 |
1 |
185 |
f |
[EDO]A:906 |
x,y,z |
1_555 |
1 |
1 |
184 |
1.0 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
44 |
|
[SO4]B:759 |
1 |
1 |
186 |
◊ |
B |
-x+1,y-1/2,-z+3/2 |
3_646 |
1 |
1 |
13603 |
1.0 |
-0.1 |
0.873 |
0 |
0 |
0 |
0.000 |
45 |
|
[SO4]B:758 |
1 |
1 |
187 |
◊ |
[SO4]B:756 |
x,y,z |
1_555 |
1 |
1 |
184 |
0.2 |
-0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
|