## |
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 |
|
D |
90 |
26 |
10054 |
◊ |
C |
x-1/2,-y+3/2,-z |
4_465 |
93 |
27 |
10076 |
804.4 |
-5.4 |
0.524 |
11 |
3 |
0 |
0.022 |
2 |
|
E |
87 |
26 |
9925 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
87 |
26 |
10021 |
802.1 |
-6.7 |
0.446 |
9 |
2 |
0 |
0.022 |
3 |
|
F |
79 |
25 |
9777 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
88 |
26 |
9950 |
691.1 |
-5.6 |
0.540 |
8 |
2 |
0 |
0.022 |
Average: |
765.9 |
-5.9 |
0.503 |
9 |
2 |
0 |
0.022 |
2 |
4 |
|
F |
55 |
18 |
9777 |
◊ |
E |
x,y,z |
1_555 |
59 |
19 |
9925 |
510.1 |
-0.7 |
0.762 |
8 |
0 |
0 |
0.000 |
5 |
|
D |
62 |
20 |
10054 |
◊ |
C |
x,y,z |
1_555 |
58 |
19 |
10076 |
503.2 |
-0.5 |
0.754 |
9 |
0 |
0 |
0.000 |
6 |
|
B |
53 |
18 |
9950 |
◊ |
A |
x,y,z |
1_555 |
52 |
18 |
10021 |
502.0 |
-0.6 |
0.760 |
6 |
0 |
0 |
0.000 |
Average: |
505.1 |
-0.6 |
0.759 |
8 |
0 |
0 |
0.000 |
3 |
7 |
|
F |
37 |
10 |
9777 |
◊ |
D |
x,y,z |
1_555 |
52 |
17 |
10054 |
382.7 |
-3.1 |
0.469 |
5 |
0 |
0 |
0.000 |
8 |
|
E |
37 |
10 |
9925 |
◊ |
A |
x,y,z |
1_555 |
50 |
17 |
10021 |
379.9 |
-3.1 |
0.469 |
4 |
0 |
0 |
0.000 |
9 |
|
F |
41 |
16 |
9777 |
◊ |
B |
x,y,z |
1_555 |
33 |
9 |
9950 |
363.6 |
-1.2 |
0.659 |
4 |
0 |
0 |
0.000 |
10 |
|
E |
44 |
16 |
9925 |
◊ |
C |
x,y,z |
1_555 |
33 |
9 |
10076 |
358.5 |
-0.9 |
0.666 |
5 |
0 |
0 |
0.000 |
Average: |
371.2 |
-2.1 |
0.566 |
5 |
0 |
0 |
0.000 |
4 |
11 |
|
D |
33 |
7 |
10054 |
◊ |
B |
x,y,z |
1_555 |
42 |
16 |
9950 |
328.4 |
-1.5 |
0.615 |
9 |
0 |
0 |
0.000 |
12 |
|
C |
41 |
16 |
10076 |
◊ |
A |
x,y,z |
1_555 |
35 |
7 |
10021 |
325.5 |
-1.3 |
0.613 |
7 |
0 |
0 |
0.000 |
Average: |
327.0 |
-1.4 |
0.614 |
8 |
0 |
0 |
0.000 |
5 |
13 |
|
D |
20 |
7 |
10054 |
◊ |
C |
x-1,y,z |
1_455 |
21 |
7 |
10076 |
164.8 |
-3.5 |
0.203 |
1 |
0 |
0 |
0.009 |
14 |
|
F |
18 |
6 |
9777 |
◊ |
E |
x-1,y,z |
1_455 |
18 |
7 |
9925 |
153.2 |
-4.4 |
0.104 |
1 |
0 |
1 |
0.009 |
15 |
|
B |
17 |
6 |
9950 |
◊ |
A |
x-1,y,z |
1_455 |
17 |
6 |
10021 |
149.1 |
-4.4 |
0.098 |
1 |
0 |
1 |
0.009 |
Average: |
155.7 |
-4.1 |
0.135 |
1 |
0 |
1 |
0.009 |
6 |
16 |
|
E |
14 |
3 |
9925 |
◊ |
B |
x,y,z |
1_555 |
15 |
3 |
9950 |
129.6 |
-2.2 |
0.301 |
0 |
0 |
0 |
0.000 |
17 |
|
F |
15 |
3 |
9777 |
◊ |
C |
x,y,z |
1_555 |
15 |
3 |
10076 |
128.7 |
-2.3 |
0.285 |
0 |
0 |
0 |
0.000 |
Average: |
129.1 |
-2.3 |
0.293 |
0 |
0 |
0 |
0.000 |
7 |
18 |
|
[SO4]B:7 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
9950 |
106.6 |
-17.4 |
0.757 |
9 |
0 |
0 |
0.039 |
8 |
19 |
|
[SO4]C:1 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
20 |
9 |
10076 |
105.7 |
-17.1 |
0.751 |
9 |
0 |
0 |
0.067 |
9 |
20 |
|
[SO4]D:2 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
18 |
8 |
10054 |
104.1 |
-16.8 |
0.746 |
8 |
0 |
0 |
0.065 |
10 |
21 |
|
[SO4]A:3 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
10021 |
103.3 |
-16.6 |
0.752 |
6 |
0 |
0 |
0.066 |
11 |
22 |
|
[SO4]B:8 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
9950 |
73.2 |
-9.9 |
0.769 |
3 |
0 |
0 |
0.021 |
12 |
23 |
|
[SO4]B:6 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
9950 |
71.4 |
-10.1 |
0.767 |
3 |
0 |
0 |
0.021 |
13 |
24 |
|
[SO4]D:10 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
7 |
2 |
10054 |
70.3 |
-8.6 |
0.982 |
5 |
0 |
0 |
0.035 |
14 |
25 |
|
[SO4]E:12 |
5 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
8 |
2 |
9925 |
69.6 |
-9.2 |
0.930 |
2 |
0 |
0 |
0.100 |
15 |
26 |
|
[SO4]C:9 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
7 |
2 |
10076 |
68.9 |
-8.9 |
0.920 |
3 |
0 |
0 |
0.033 |
16 |
27 |
|
E |
6 |
2 |
9925 |
x |
B |
-x+2,y-1/2,-z+1/2 |
3_745 |
10 |
5 |
9950 |
68.3 |
-0.4 |
0.482 |
0 |
0 |
0 |
0.000 |
28 |
|
F |
4 |
2 |
9777 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
8 |
5 |
10021 |
64.6 |
-0.2 |
0.482 |
0 |
0 |
0 |
0.000 |
29 |
|
D |
5 |
2 |
10054 |
x |
D |
x-1/2,-y+3/2,-z |
4_465 |
8 |
5 |
10054 |
64.4 |
-0.2 |
0.454 |
0 |
0 |
0 |
0.000 |
30 |
|
C |
8 |
5 |
10076 |
x |
C |
x-1/2,-y+3/2,-z |
4_465 |
5 |
2 |
10076 |
57.8 |
0.1 |
0.536 |
0 |
0 |
0 |
0.000 |
31 |
|
F |
8 |
5 |
9777 |
x |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
4 |
2 |
10021 |
52.0 |
-0.2 |
0.492 |
0 |
0 |
0 |
0.000 |
32 |
|
E |
7 |
4 |
9925 |
x |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
3 |
1 |
9950 |
46.3 |
0.0 |
0.503 |
0 |
0 |
0 |
0.000 |
Average: |
58.9 |
-0.1 |
0.492 |
0 |
0 |
0 |
0.000 |
17 |
33 |
|
[SO4]B:5 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
8 |
2 |
9950 |
67.7 |
-8.8 |
0.930 |
3 |
0 |
0 |
0.019 |
18 |
34 |
|
[SO4]A:4 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
10021 |
66.8 |
-8.4 |
0.939 |
3 |
0 |
0 |
0.034 |
19 |
35 |
|
[SO4]F:11 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
7 |
2 |
9777 |
64.7 |
-8.4 |
0.924 |
2 |
0 |
0 |
0.100 |
20 |
36 |
|
E |
7 |
2 |
9925 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
10054 |
49.6 |
-1.0 |
0.276 |
0 |
0 |
0 |
0.000 |
21 |
37 |
|
D |
3 |
1 |
10054 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
10021 |
24.8 |
-0.7 |
0.287 |
0 |
0 |
0 |
0.000 |
22 |
38 |
|
[SO4]D:2 |
1 |
1 |
186 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
9777 |
20.8 |
-3.1 |
0.425 |
0 |
0 |
0 |
0.000 |
23 |
39 |
|
[SO4]A:3 |
1 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
9925 |
20.6 |
-3.1 |
0.423 |
0 |
0 |
0 |
0.000 |
24 |
40 |
|
[SO4]B:8 |
4 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
10054 |
11.4 |
-0.9 |
0.875 |
0 |
0 |
0 |
0.000 |
25 |
41 |
|
[SO4]B:6 |
3 |
1 |
185 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
2 |
10021 |
10.9 |
-1.7 |
0.477 |
0 |
0 |
0 |
0.002 |
|