## |
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 |
|
E |
271 |
64 |
25448 |
◊ |
D |
x,y,z |
1_555 |
289 |
75 |
25254 |
2748.2 |
-27.8 |
0.031 |
30 |
11 |
0 |
0.703 |
2 |
|
H |
313 |
84 |
25423 |
◊ |
A |
x,y,z |
1_555 |
274 |
66 |
25192 |
2726.6 |
-27.6 |
0.031 |
31 |
7 |
0 |
0.703 |
3 |
|
B |
274 |
67 |
25612 |
◊ |
A |
x,y,z |
1_555 |
287 |
79 |
25192 |
2706.2 |
-26.5 |
0.039 |
34 |
13 |
0 |
0.703 |
4 |
|
D |
266 |
67 |
25254 |
◊ |
C |
x,y,z |
1_555 |
299 |
79 |
25530 |
2704.2 |
-25.1 |
0.043 |
37 |
11 |
0 |
0.703 |
5 |
|
C |
263 |
66 |
25530 |
◊ |
B |
x,y,z |
1_555 |
284 |
75 |
25612 |
2647.4 |
-24.8 |
0.044 |
34 |
11 |
0 |
0.703 |
6 |
|
H |
264 |
65 |
25423 |
◊ |
G |
x,y,z |
1_555 |
287 |
77 |
25426 |
2633.1 |
-25.5 |
0.041 |
37 |
17 |
0 |
0.703 |
7 |
|
G |
252 |
66 |
25426 |
◊ |
F |
x,y,z |
1_555 |
278 |
79 |
25358 |
2616.2 |
-29.0 |
0.019 |
30 |
9 |
0 |
0.703 |
8 |
|
F |
259 |
63 |
25358 |
◊ |
E |
x,y,z |
1_555 |
271 |
70 |
25448 |
2550.0 |
-27.7 |
0.024 |
25 |
12 |
0 |
0.703 |
Average: |
2666.5 |
-26.7 |
0.034 |
32 |
11 |
0 |
0.703 |
2 |
9 |
|
G |
113 |
31 |
25426 |
◊ |
A |
y-1,x+1,-z |
4_465 |
107 |
30 |
25192 |
1056.6 |
7.7 |
0.933 |
12 |
17 |
0 |
0.000 |
10 |
|
F |
100 |
29 |
25358 |
◊ |
B |
y-1,x+1,-z |
4_465 |
103 |
31 |
25612 |
1038.1 |
7.9 |
0.938 |
10 |
14 |
0 |
0.000 |
11 |
|
H |
94 |
28 |
25423 |
◊ |
H |
y-1,x+1,-z |
4_465 |
95 |
28 |
25423 |
994.6 |
8.0 |
0.936 |
12 |
8 |
0 |
0.000 |
12 |
|
E |
100 |
28 |
25448 |
◊ |
C |
y-1,x+1,-z |
4_465 |
103 |
31 |
25530 |
993.3 |
7.2 |
0.920 |
9 |
12 |
0 |
0.000 |
13 |
|
D |
103 |
29 |
25254 |
◊ |
D |
y-1,x+1,-z |
4_465 |
103 |
29 |
25254 |
992.6 |
2.2 |
0.776 |
8 |
12 |
0 |
0.000 |
Average: |
1015.0 |
6.6 |
0.901 |
10 |
13 |
0 |
0.000 |
3 |
14 |
|
G |
53 |
12 |
25426 |
◊ |
B |
y-1,x+1,-z |
4_465 |
53 |
12 |
25612 |
480.1 |
-0.6 |
0.578 |
3 |
2 |
0 |
0.000 |
15 |
|
F |
56 |
14 |
25358 |
◊ |
C |
y-1,x+1,-z |
4_465 |
49 |
13 |
25530 |
461.6 |
-0.7 |
0.557 |
2 |
2 |
0 |
0.000 |
16 |
|
E |
58 |
14 |
25448 |
◊ |
D |
y-1,x+1,-z |
4_465 |
51 |
13 |
25254 |
456.7 |
-1.1 |
0.549 |
2 |
2 |
0 |
0.000 |
17 |
|
H |
48 |
13 |
25423 |
◊ |
A |
y-1,x+1,-z |
4_465 |
55 |
13 |
25192 |
424.8 |
-0.5 |
0.579 |
3 |
0 |
0 |
0.000 |
Average: |
455.8 |
-0.7 |
0.566 |
3 |
2 |
0 |
0.000 |
4 |
18 |
|
E |
51 |
16 |
25448 |
◊ |
C |
x-y,-y+1,-z+1/3 |
5_565 |
44 |
14 |
25530 |
395.5 |
-1.3 |
0.498 |
3 |
1 |
0 |
0.000 |
5 |
19 |
|
A |
38 |
14 |
25192 |
◊ |
B |
y-1,x,-z |
4_455 |
46 |
17 |
25612 |
379.5 |
1.9 |
0.750 |
4 |
3 |
0 |
0.000 |
6 |
20 |
|
F |
46 |
13 |
25358 |
◊ |
D |
x-y,-y+1,-z+1/3 |
5_565 |
36 |
14 |
25254 |
362.1 |
2.1 |
0.772 |
5 |
3 |
0 |
0.000 |
7 |
21 |
|
A |
45 |
11 |
25192 |
◊ |
E |
x,y-1,z |
1_545 |
40 |
14 |
25448 |
345.3 |
-4.0 |
0.257 |
3 |
0 |
0 |
0.000 |
8 |
22 |
|
H |
31 |
13 |
25423 |
◊ |
D |
x-1,y-1,z |
1_445 |
30 |
12 |
25254 |
313.7 |
0.9 |
0.693 |
6 |
0 |
0 |
0.000 |
9 |
23 |
|
F |
28 |
9 |
25358 |
◊ |
C |
x-y,-y+1,-z+1/3 |
5_565 |
35 |
12 |
25530 |
245.4 |
1.2 |
0.705 |
1 |
0 |
0 |
0.000 |
10 |
24 |
|
H |
22 |
9 |
25423 |
◊ |
H |
x-y,-y,-z+1/3 |
5_555 |
22 |
9 |
25423 |
164.3 |
-0.3 |
0.548 |
0 |
0 |
0 |
0.000 |
11 |
25 |
|
H |
13 |
6 |
25423 |
◊ |
G |
x-y,-y,-z+1/3 |
5_555 |
14 |
8 |
25426 |
116.8 |
2.1 |
0.751 |
0 |
0 |
0 |
0.000 |
12 |
26 |
|
[SO4]G:601 |
5 |
1 |
185 |
cf |
G |
x,y,z |
1_555 |
20 |
11 |
25426 |
112.3 |
-16.5 |
0.700 |
2 |
0 |
0 |
0.100 |
13 |
27 |
|
[SO4]B:601 |
5 |
1 |
185 |
cf |
B |
x,y,z |
1_555 |
17 |
10 |
25612 |
110.1 |
-17.1 |
0.627 |
2 |
0 |
0 |
0.100 |
14 |
28 |
|
[SO4]F:601 |
5 |
1 |
186 |
cf |
F |
x,y,z |
1_555 |
25 |
14 |
25358 |
108.5 |
-16.1 |
0.751 |
2 |
0 |
0 |
0.100 |
15 |
29 |
|
[SO4]H:601 |
5 |
1 |
185 |
cf |
H |
x,y,z |
1_555 |
21 |
12 |
25423 |
105.7 |
-16.7 |
0.670 |
3 |
0 |
0 |
0.100 |
16 |
30 |
|
[SO4]E:601 |
5 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
20 |
11 |
25448 |
104.1 |
-14.7 |
0.755 |
5 |
0 |
0 |
0.100 |
17 |
31 |
|
[SO4]D:601 |
5 |
1 |
185 |
cf |
D |
x,y,z |
1_555 |
18 |
11 |
25254 |
102.7 |
-15.4 |
0.776 |
3 |
0 |
0 |
0.100 |
18 |
32 |
|
[SO4]A:601 |
5 |
1 |
185 |
cf |
A |
x,y,z |
1_555 |
22 |
11 |
25192 |
101.4 |
-16.4 |
0.730 |
4 |
0 |
0 |
0.100 |
19 |
33 |
|
[SO4]C:601 |
5 |
1 |
183 |
cf |
C |
x,y,z |
1_555 |
18 |
9 |
25530 |
99.7 |
-15.6 |
0.713 |
3 |
0 |
0 |
0.100 |
20 |
34 |
|
A |
11 |
5 |
25192 |
◊ |
C |
y-1,x,-z |
4_455 |
9 |
6 |
25530 |
82.8 |
1.0 |
0.675 |
1 |
0 |
0 |
0.000 |
21 |
35 |
|
E |
10 |
4 |
25448 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
7 |
2 |
25612 |
73.7 |
0.5 |
0.689 |
1 |
1 |
0 |
0.000 |
22 |
36 |
|
D |
8 |
4 |
25254 |
◊ |
C |
y-1,x+1,-z |
4_465 |
10 |
4 |
25530 |
56.2 |
0.5 |
0.692 |
0 |
0 |
0 |
0.000 |
37 |
|
F |
9 |
4 |
25358 |
◊ |
A |
y-1,x+1,-z |
4_465 |
9 |
4 |
25192 |
50.8 |
0.6 |
0.708 |
0 |
0 |
0 |
0.000 |
38 |
|
H |
6 |
4 |
25423 |
◊ |
G |
y-1,x+1,-z |
4_465 |
8 |
4 |
25426 |
45.7 |
0.5 |
0.708 |
0 |
0 |
0 |
0.000 |
39 |
|
E |
8 |
4 |
25448 |
◊ |
B |
y-1,x+1,-z |
4_465 |
8 |
4 |
25612 |
38.3 |
0.5 |
0.695 |
0 |
0 |
0 |
0.000 |
Average: |
47.7 |
0.5 |
0.701 |
0 |
0 |
0 |
0.000 |
23 |
40 |
|
G |
3 |
1 |
25426 |
◊ |
G |
x-y,-y,-z+1/3 |
5_555 |
3 |
1 |
25426 |
45.0 |
0.1 |
0.668 |
0 |
0 |
0 |
0.000 |
24 |
41 |
|
G |
7 |
4 |
25426 |
◊ |
B |
x-1,y,z |
1_455 |
6 |
4 |
25612 |
35.1 |
-0.1 |
0.583 |
0 |
0 |
0 |
0.000 |
25 |
42 |
|
H |
3 |
1 |
25423 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
25358 |
34.9 |
-0.8 |
0.201 |
0 |
0 |
0 |
0.010 |
43 |
|
G |
3 |
2 |
25426 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
25192 |
34.2 |
-0.8 |
0.173 |
0 |
0 |
0 |
0.010 |
44 |
|
H |
3 |
2 |
25423 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
25612 |
31.4 |
-0.7 |
0.227 |
0 |
0 |
0 |
0.010 |
45 |
|
G |
3 |
1 |
25426 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
25448 |
29.7 |
-0.6 |
0.216 |
0 |
0 |
0 |
0.010 |
46 |
|
D |
4 |
2 |
25254 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
25612 |
29.0 |
-0.5 |
0.332 |
0 |
0 |
0 |
0.010 |
47 |
|
F |
4 |
2 |
25358 |
◊ |
D |
x,y,z |
1_555 |
5 |
3 |
25254 |
28.4 |
-0.6 |
0.382 |
0 |
0 |
0 |
0.010 |
48 |
|
C |
3 |
1 |
25530 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
25192 |
28.4 |
-0.5 |
0.249 |
0 |
0 |
0 |
0.010 |
49 |
|
E |
3 |
1 |
25448 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
25530 |
27.6 |
-0.5 |
0.228 |
0 |
0 |
0 |
0.010 |
Average: |
30.5 |
-0.6 |
0.251 |
0 |
0 |
0 |
0.010 |
|