| ## |
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 |
|
C |
97 |
22 |
9489 |
◊ |
A |
-y+1,-x+1,-z+5/6 |
10_665 |
95 |
22 |
10354 |
837.6 |
-2.6 |
0.628 |
13 |
2 |
0 |
0.087 |
2 |
|
B |
93 |
22 |
9197 |
◊ |
B |
-y+1,-x+1,-z+5/6 |
10_665 |
95 |
23 |
9197 |
832.8 |
-3.5 |
0.607 |
8 |
2 |
0 |
0.087 |
| Average: |
835.2 |
-3.0 |
0.617 |
11 |
2 |
0 |
0.087 |
| 2 |
3 |
|
C |
67 |
19 |
9489 |
◊ |
C |
-y+1,-x+1,-z+5/6 |
10_665 |
66 |
19 |
9489 |
734.9 |
-9.6 |
0.091 |
10 |
8 |
0 |
0.153 |
4 |
|
B |
67 |
20 |
9197 |
◊ |
A |
-y+1,-x+1,-z+5/6 |
10_665 |
70 |
19 |
10354 |
722.0 |
-11.5 |
0.056 |
10 |
6 |
0 |
0.153 |
| Average: |
728.5 |
-10.6 |
0.073 |
10 |
7 |
0 |
0.153 |
| 3 |
5 |
|
A |
82 |
18 |
10354 |
◊ |
A |
x-y,-y,-z+1 |
8_556 |
82 |
18 |
10354 |
699.4 |
-6.9 |
0.320 |
8 |
0 |
0 |
0.052 |
| 4 |
6 |
|
B |
47 |
13 |
9197 |
◊ |
A |
x,x-y,-z+7/6 |
12_556 |
38 |
9 |
10354 |
354.9 |
-1.5 |
0.568 |
3 |
0 |
0 |
0.000 |
| 5 |
7 |
|
B |
43 |
13 |
9197 |
◊ |
A |
x,y,z |
1_555 |
39 |
12 |
10354 |
353.6 |
1.7 |
0.831 |
3 |
2 |
0 |
0.000 |
8 |
|
C |
38 |
14 |
9489 |
◊ |
B |
x,y,z |
1_555 |
37 |
12 |
9197 |
338.1 |
2.9 |
0.862 |
3 |
0 |
0 |
0.000 |
9 |
|
C |
35 |
12 |
9489 |
◊ |
A |
x,y,z |
1_555 |
40 |
13 |
10354 |
297.0 |
1.0 |
0.748 |
2 |
2 |
0 |
0.000 |
| Average: |
329.6 |
1.9 |
0.814 |
3 |
1 |
0 |
0.000 |
| 6 |
10 |
|
A |
39 |
13 |
10354 |
◊ |
C |
x-y,x-1,z+1/6 |
6_545 |
39 |
9 |
9489 |
332.2 |
-3.5 |
0.348 |
4 |
0 |
0 |
0.053 |
| 7 |
11 |
|
[SO4]B:201 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
24 |
9 |
9197 |
121.0 |
-18.7 |
0.636 |
6 |
0 |
0 |
0.194 |
| 8 |
12 |
|
[SO4]C:401 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
24 |
9 |
9489 |
116.8 |
-19.1 |
0.470 |
5 |
0 |
0 |
0.407 |
| 9 |
13 |
|
[SO4]A:190 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
23 |
8 |
10354 |
116.6 |
-17.8 |
0.642 |
6 |
0 |
0 |
0.205 |
| 10 |
14 |
|
[SO4]B:202 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
9197 |
92.6 |
-12.5 |
0.928 |
6 |
0 |
0 |
0.138 |
| 11 |
15 |
|
[SO4]A:191 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
10354 |
85.1 |
-11.9 |
0.894 |
7 |
0 |
0 |
0.151 |
| 12 |
16 |
|
[SO4]C:402 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
9489 |
84.3 |
-12.0 |
0.861 |
7 |
0 |
0 |
0.287 |
| 13 |
17 |
|
[SO4]B:203 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
9197 |
83.9 |
-10.8 |
0.912 |
2 |
0 |
0 |
0.106 |
| 14 |
18 |
|
[SO4]B:203 |
5 |
1 |
185 |
◊ |
A |
-y+1,-x+1,-z+5/6 |
10_665 |
7 |
3 |
10354 |
73.8 |
-8.9 |
0.890 |
2 |
0 |
0 |
0.089 |
| 15 |
19 |
|
[SO4]C:403 |
5 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
11 |
4 |
9489 |
72.5 |
-9.5 |
0.859 |
1 |
0 |
0 |
0.135 |
| 16 |
20 |
|
[SO4]A:601 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
5 |
2 |
9489 |
61.1 |
-6.7 |
0.964 |
4 |
0 |
0 |
0.161 |
| 17 |
21 |
|
[SO4]A:601 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
10354 |
54.9 |
-5.7 |
0.950 |
3 |
0 |
0 |
0.038 |
| 18 |
22 |
|
[SO4]C:403 |
5 |
1 |
186 |
◊ |
C |
-y+1,-x+1,-z+5/6 |
10_665 |
7 |
3 |
9489 |
53.9 |
-5.6 |
0.910 |
1 |
0 |
0 |
0.082 |
| 19 |
23 |
|
[SO4]A:601 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
9197 |
49.1 |
-5.4 |
0.936 |
2 |
0 |
0 |
0.033 |
| 20 |
24 |
|
[SO4]C:403 |
4 |
1 |
186 |
f |
[SO4]C:403 |
-y+1,-x+1,-z+5/6 |
10_665 |
4 |
1 |
186 |
44.1 |
-10.0 |
0.973 |
0 |
0 |
0 |
0.100 |
| 21 |
25 |
|
B |
2 |
2 |
9197 |
◊ |
B |
x,x-y,-z+7/6 |
12_556 |
2 |
2 |
9197 |
35.1 |
0.9 |
0.909 |
0 |
0 |
0 |
0.000 |
| 22 |
26 |
|
[SO4]C:403 |
1 |
1 |
186 |
◊ |
A |
-y+1,-x+1,-z+5/6 |
10_665 |
1 |
1 |
10354 |
1.2 |
-0.1 |
0.877 |
0 |
0 |
0 |
0.000 |
|