## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
A |
48 |
15 |
10299 |
◊ |
A |
-y,-x,-z+1/2 |
8_555 |
48 |
15 |
10299 |
424.6 |
-0.9 |
0.528 |
6 |
0 |
0 |
0.000 |
2 |
2 |
|
A |
42 |
12 |
10299 |
x |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
46 |
13 |
10299 |
405.7 |
0.7 |
0.558 |
6 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
36 |
12 |
10299 |
x |
A |
-y+1/2,x+1/2,z-1/4 |
3_554 |
34 |
10 |
10299 |
290.4 |
-0.6 |
0.509 |
3 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
28 |
9 |
10299 |
x |
A |
-y+1/2,x-1/2,z-1/4 |
3_544 |
28 |
9 |
10299 |
268.1 |
1.0 |
0.606 |
5 |
1 |
0 |
0.000 |
5 |
5 |
|
A |
24 |
4 |
10299 |
x |
A |
-x+1/2,y-1/2,-z+3/4 |
5_545 |
25 |
11 |
10299 |
221.0 |
1.2 |
0.723 |
1 |
0 |
0 |
0.000 |
6 |
6 |
|
A |
14 |
6 |
10299 |
x |
A |
-y,-x+1,-z+1/2 |
8_565 |
8 |
2 |
10299 |
96.1 |
-2.5 |
0.047 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
[EDO]A:309 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
10299 |
90.1 |
2.8 |
0.303 |
5 |
0 |
0 |
0.000 |
8 |
8 |
|
[EDO]A:308 |
4 |
1 |
183 |
◊ |
A |
-y+1/2,x-1/2,z-1/4 |
3_544 |
13 |
6 |
10299 |
85.3 |
2.4 |
0.417 |
0 |
0 |
0 |
0.000 |
9 |
9 |
|
[EDO]A:308 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
10299 |
70.9 |
1.2 |
0.219 |
3 |
0 |
0 |
0.000 |
10 |
10 |
|
[SO4]A:310 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
10299 |
66.1 |
-9.3 |
0.788 |
6 |
0 |
0 |
0.036 |
11 |
11 |
|
[SO4]A:311 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
10299 |
52.9 |
-6.7 |
0.806 |
5 |
0 |
0 |
0.027 |
12 |
12 |
|
[TE]A:302 |
1 |
1 |
150 |
f |
A |
x,y,z |
1_555 |
17 |
11 |
10299 |
50.4 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.009 |
13 |
13 |
|
[CA]A:301 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
10299 |
46.2 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.034 |
14 |
14 |
|
[SO4]A:310 |
3 |
1 |
186 |
◊ |
A |
-x+1/2,y-1/2,-z+3/4 |
5_545 |
7 |
2 |
10299 |
35.1 |
-4.6 |
0.712 |
0 |
0 |
0 |
0.000 |
15 |
15 |
|
[O]A:305 |
1 |
1 |
99 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
10299 |
28.8 |
0.6 |
0.842 |
0 |
0 |
0 |
0.000 |
16 |
|
[O]A:306 |
1 |
1 |
99 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
10299 |
24.5 |
0.5 |
0.803 |
0 |
0 |
0 |
0.000 |
Average: |
26.7 |
0.6 |
0.823 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[O]A:303 |
1 |
1 |
99 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
10299 |
28.6 |
0.3 |
0.748 |
0 |
0 |
0 |
0.000 |
18 |
|
[O]A:304 |
1 |
1 |
99 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
10299 |
26.8 |
0.4 |
0.809 |
0 |
0 |
0 |
0.000 |
19 |
|
[O]A:307 |
1 |
1 |
99 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
10299 |
25.0 |
0.5 |
0.845 |
0 |
0 |
0 |
0.000 |
Average: |
26.8 |
0.4 |
0.801 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
[O]A:307 |
1 |
1 |
99 |
f |
[TE]A:302 |
x,y,z |
1_555 |
1 |
1 |
150 |
21.3 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.002 |
18 |
21 |
|
[O]A:304 |
1 |
1 |
99 |
f |
[TE]A:302 |
x,y,z |
1_555 |
1 |
1 |
150 |
20.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.002 |
19 |
22 |
|
[O]A:305 |
1 |
1 |
99 |
f |
[TE]A:302 |
x,y,z |
1_555 |
1 |
1 |
150 |
20.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.002 |
20 |
23 |
|
[O]A:306 |
1 |
1 |
99 |
f |
[TE]A:302 |
x,y,z |
1_555 |
1 |
1 |
150 |
19.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.002 |
21 |
24 |
|
[O]A:303 |
1 |
1 |
99 |
f |
[TE]A:302 |
x,y,z |
1_555 |
1 |
1 |
150 |
19.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.002 |
22 |
25 |
|
A |
3 |
2 |
10299 |
◊ |
[SO4]A:311 |
-y+1/2,x+1/2,z-1/4 |
3_554 |
3 |
1 |
186 |
19.3 |
-1.8 |
0.916 |
0 |
0 |
0 |
0.000 |
23 |
26 |
|
[O]A:307 |
1 |
1 |
99 |
f |
[O]A:304 |
x,y,z |
1_555 |
1 |
1 |
99 |
12.7 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
24 |
27 |
|
[O]A:304 |
1 |
1 |
99 |
f |
[O]A:303 |
x,y,z |
1_555 |
1 |
1 |
99 |
12.5 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
25 |
28 |
|
[O]A:307 |
1 |
1 |
99 |
f |
[O]A:303 |
x,y,z |
1_555 |
1 |
1 |
99 |
12.0 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
26 |
29 |
|
[O]A:306 |
1 |
1 |
99 |
f |
[O]A:305 |
x,y,z |
1_555 |
1 |
1 |
99 |
11.8 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
27 |
30 |
|
[O]A:307 |
1 |
1 |
99 |
f |
[O]A:305 |
x,y,z |
1_555 |
1 |
1 |
99 |
11.4 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
28 |
31 |
|
[O]A:307 |
1 |
1 |
99 |
f |
[O]A:306 |
x,y,z |
1_555 |
1 |
1 |
99 |
11.2 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
29 |
32 |
|
[O]A:305 |
1 |
1 |
99 |
f |
[O]A:304 |
x,y,z |
1_555 |
1 |
1 |
99 |
11.2 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
30 |
33 |
|
[O]A:306 |
1 |
1 |
99 |
f |
[O]A:303 |
x,y,z |
1_555 |
1 |
1 |
99 |
10.4 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
31 |
34 |
|
[O]A:306 |
1 |
1 |
99 |
f |
[O]A:304 |
x,y,z |
1_555 |
1 |
1 |
99 |
7.3 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
32 |
35 |
|
[O]A:305 |
1 |
1 |
99 |
f |
[O]A:303 |
x,y,z |
1_555 |
1 |
1 |
99 |
6.9 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
|