## |
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 |
240 |
57 |
13847 |
◊ |
A |
x,y,z |
1_555 |
239 |
58 |
13994 |
2301.9 |
-11.5 |
0.345 |
42 |
18 |
0 |
0.275 |
2 |
|
A |
93 |
30 |
13994 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
81 |
23 |
13994 |
782.2 |
-5.0 |
0.352 |
9 |
4 |
0 |
0.000 |
3 |
|
B |
55 |
17 |
13847 |
x |
B |
-x+2,y-1/2,-z+1/2 |
3_745 |
47 |
17 |
13847 |
449.9 |
-2.9 |
0.377 |
4 |
0 |
0 |
0.000 |
4 |
|
B |
27 |
14 |
13847 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
31 |
11 |
13994 |
286.9 |
0.9 |
0.713 |
4 |
2 |
0 |
0.000 |
5 |
|
[EDO]B:302 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
26 |
8 |
13847 |
128.2 |
3.3 |
0.562 |
1 |
0 |
0 |
0.000 |
6 |
|
[EDO]B:308 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
13847 |
110.2 |
4.4 |
0.528 |
2 |
0 |
0 |
0.000 |
7 |
|
[EDO]B:307 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
19 |
6 |
13847 |
103.3 |
2.8 |
0.451 |
2 |
0 |
0 |
0.000 |
8 |
|
[EDO]B:303 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
13847 |
99.7 |
2.9 |
0.408 |
1 |
0 |
0 |
0.000 |
9 |
|
[EDO]B:304 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
18 |
8 |
13847 |
93.3 |
3.2 |
0.489 |
3 |
0 |
0 |
0.000 |
10 |
|
[SO4]B:310 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
13847 |
82.3 |
-10.1 |
0.934 |
3 |
0 |
0 |
0.096 |
11 |
|
[EDO]B:305 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
13847 |
80.4 |
2.4 |
0.269 |
2 |
0 |
0 |
0.000 |
12 |
|
[EDO]B:301 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
13847 |
75.3 |
1.7 |
0.203 |
1 |
0 |
0 |
0.000 |
13 |
|
[SO4]A:304 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
13847 |
72.7 |
-9.5 |
0.759 |
2 |
0 |
0 |
0.087 |
14 |
|
[SO4]A:305 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
13994 |
72.3 |
-10.2 |
0.768 |
4 |
0 |
0 |
0.100 |
15 |
|
[SO4]B:309 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
13847 |
72.2 |
-10.0 |
0.776 |
4 |
0 |
0 |
0.099 |
16 |
|
[SO4]A:303 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
13994 |
71.9 |
-10.1 |
0.648 |
3 |
0 |
0 |
0.095 |
17 |
|
[SO4]B:311 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
13847 |
70.7 |
-9.5 |
0.750 |
3 |
0 |
0 |
0.091 |
18 |
|
[EDO]A:301 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
13994 |
68.3 |
0.9 |
0.665 |
4 |
0 |
0 |
0.008 |
19 |
|
[SO4]A:303 |
5 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
13847 |
64.8 |
-7.4 |
0.866 |
1 |
0 |
0 |
0.066 |
20 |
|
[SO4]A:304 |
5 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
13994 |
63.6 |
-8.2 |
0.830 |
2 |
0 |
0 |
0.076 |
21 |
|
[EDO]A:302 |
3 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
13994 |
62.9 |
1.6 |
0.262 |
2 |
0 |
0 |
0.000 |
22 |
|
[SO4]B:311 |
5 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
13994 |
62.3 |
-7.1 |
0.855 |
1 |
0 |
0 |
0.063 |
23 |
|
[EDO]B:306 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
13847 |
56.4 |
0.6 |
0.592 |
1 |
0 |
0 |
0.000 |
24 |
|
B |
6 |
2 |
13847 |
◊ |
[EDO]A:301 |
-x+3/2,-y+1,z-1/2 |
2_664 |
4 |
1 |
184 |
46.5 |
0.8 |
0.585 |
0 |
0 |
0 |
0.000 |
25 |
|
[EDO]B:304 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
8 |
2 |
13994 |
45.8 |
1.4 |
0.273 |
0 |
0 |
0 |
0.000 |
26 |
|
A |
5 |
3 |
13994 |
◊ |
B |
-x+3/2,-y+1,z-1/2 |
2_664 |
6 |
2 |
13847 |
36.5 |
0.7 |
0.720 |
0 |
0 |
0 |
0.000 |
27 |
|
[SO4]B:311 |
4 |
1 |
186 |
f |
[EDO]B:301 |
x,y,z |
1_555 |
4 |
1 |
184 |
33.5 |
-3.3 |
0.999 |
2 |
0 |
0 |
0.035 |
28 |
|
[SO4]A:304 |
3 |
1 |
185 |
◊ |
[SO4]A:303 |
x,y,z |
1_555 |
2 |
1 |
185 |
26.3 |
-6.2 |
0.976 |
0 |
0 |
0 |
0.052 |
29 |
|
[EDO]B:301 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
13994 |
26.1 |
1.3 |
0.978 |
1 |
0 |
0 |
0.000 |
30 |
|
A |
3 |
1 |
13994 |
◊ |
B |
x-1/2,-y+3/2,-z |
4_465 |
3 |
1 |
13847 |
15.7 |
0.1 |
0.585 |
0 |
0 |
0 |
0.000 |
31 |
|
[SO4]B:310 |
3 |
1 |
185 |
f |
[SO4]B:309 |
x,y,z |
1_555 |
1 |
1 |
185 |
6.2 |
-1.5 |
0.891 |
0 |
0 |
0 |
0.012 |
32 |
|
[EDO]B:306 |
3 |
1 |
184 |
◊ |
[EDO]A:301 |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
184 |
5.5 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
33 |
|
B |
2 |
1 |
13847 |
◊ |
[SO4]B:309 |
-x+3/2,-y+2,z-1/2 |
2_674 |
1 |
1 |
185 |
4.5 |
-0.5 |
0.691 |
0 |
0 |
0 |
0.000 |
34 |
|
[EDO]B:306 |
2 |
1 |
184 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
1 |
1 |
13994 |
1.7 |
0.1 |
0.843 |
0 |
0 |
0 |
0.000 |
|