| ## |
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 |
122 |
37 |
23312 |
◊ |
C |
x-1/2,-y+1/2,-z |
8_455 |
126 |
34 |
23361 |
1255.5 |
-26.2 |
0.001 |
2 |
0 |
0 |
0.260 |
| 2 |
2 |
|
B |
127 |
35 |
23580 |
◊ |
B |
-x-1,y,-z-1/2 |
3_454 |
126 |
35 |
23580 |
1251.0 |
-26.7 |
0.001 |
2 |
0 |
0 |
0.364 |
3 |
|
D |
116 |
34 |
23056 |
◊ |
D |
-x,y,-z-1/2 |
3_554 |
117 |
34 |
23056 |
1249.3 |
-26.8 |
0.000 |
2 |
0 |
0 |
0.364 |
| Average: |
1250.2 |
-26.7 |
0.000 |
2 |
0 |
0 |
0.364 |
| 3 |
4 |
|
D |
120 |
34 |
23056 |
◊ |
B |
x,y,z |
1_555 |
112 |
31 |
23580 |
1073.0 |
-7.4 |
0.352 |
12 |
2 |
0 |
0.019 |
5 |
|
C |
110 |
34 |
23361 |
◊ |
A |
x,y,z |
1_555 |
114 |
32 |
23312 |
1071.1 |
-10.1 |
0.173 |
9 |
0 |
0 |
0.019 |
| Average: |
1072.0 |
-8.8 |
0.263 |
11 |
1 |
0 |
0.019 |
| 4 |
6 |
|
C |
86 |
26 |
23361 |
◊ |
C |
x,-y+1,-z |
4_565 |
86 |
26 |
23361 |
840.6 |
-3.0 |
0.539 |
16 |
4 |
0 |
0.091 |
7 |
|
A |
71 |
21 |
23312 |
◊ |
A |
x,-y,-z |
4_555 |
71 |
21 |
23312 |
690.1 |
-3.3 |
0.459 |
10 |
0 |
0 |
0.091 |
8 |
|
D |
67 |
23 |
23056 |
◊ |
B |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
66 |
21 |
23580 |
638.2 |
-4.4 |
0.377 |
9 |
0 |
0 |
0.091 |
| Average: |
723.0 |
-3.6 |
0.458 |
12 |
1 |
0 |
0.091 |
| 5 |
9 |
|
D |
43 |
14 |
23056 |
◊ |
A |
x,y,z |
1_555 |
41 |
13 |
23312 |
409.8 |
-1.9 |
0.468 |
2 |
0 |
0 |
0.000 |
10 |
|
C |
38 |
14 |
23361 |
◊ |
B |
x,y,z |
1_555 |
36 |
14 |
23580 |
336.0 |
-1.9 |
0.459 |
3 |
0 |
0 |
0.000 |
| Average: |
372.9 |
-1.9 |
0.463 |
3 |
0 |
0 |
0.000 |
| 6 |
11 |
|
D |
42 |
17 |
23056 |
◊ |
C |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
33 |
11 |
23361 |
255.1 |
0.7 |
0.721 |
1 |
2 |
0 |
0.000 |
| 7 |
12 |
|
B |
27 |
10 |
23580 |
◊ |
A |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
25 |
10 |
23312 |
223.8 |
2.5 |
0.718 |
3 |
0 |
0 |
0.000 |
| 8 |
13 |
|
D |
20 |
8 |
23056 |
◊ |
C |
x,y,z |
1_555 |
31 |
11 |
23361 |
214.7 |
-1.9 |
0.376 |
2 |
1 |
0 |
0.000 |
| 9 |
14 |
|
C |
10 |
4 |
23361 |
◊ |
B |
-x,y,-z-1/2 |
3_554 |
9 |
2 |
23580 |
114.7 |
0.3 |
0.580 |
1 |
1 |
0 |
0.000 |
| 10 |
15 |
|
D |
12 |
5 |
23056 |
◊ |
A |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
14 |
5 |
23312 |
113.1 |
1.5 |
0.790 |
3 |
0 |
0 |
0.000 |
| 11 |
16 |
|
[SO4]A:4102 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
23312 |
104.7 |
-16.4 |
0.779 |
5 |
0 |
0 |
0.178 |
| 12 |
17 |
|
[SO4]D:4101 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
19 |
11 |
23056 |
101.6 |
-15.2 |
0.686 |
2 |
0 |
0 |
0.344 |
| 13 |
18 |
|
[SO4]B:4101 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
18 |
11 |
23580 |
101.0 |
-15.3 |
0.683 |
3 |
0 |
0 |
0.439 |
| 14 |
19 |
|
[SO4]C:4101 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
16 |
9 |
23361 |
99.8 |
-15.4 |
0.662 |
2 |
0 |
0 |
0.157 |
| 15 |
20 |
|
[SO4]D:4102 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
16 |
8 |
23056 |
98.0 |
-15.0 |
0.789 |
4 |
0 |
0 |
0.359 |
| 16 |
21 |
|
[SO4]A:4101 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
23312 |
97.8 |
-14.4 |
0.666 |
3 |
0 |
0 |
0.151 |
| 17 |
22 |
|
[SO4]C:4102 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
23361 |
83.3 |
-11.6 |
0.911 |
5 |
0 |
0 |
0.132 |
| 18 |
23 |
|
[SO4]C:4103 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
6 |
2 |
23361 |
65.2 |
-7.8 |
0.947 |
4 |
0 |
0 |
0.091 |
| 19 |
24 |
|
[SO4]B:4102 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
23580 |
53.2 |
-7.0 |
0.491 |
1 |
0 |
0 |
0.196 |
| 20 |
25 |
|
B |
6 |
2 |
23580 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
7 |
3 |
23312 |
50.0 |
1.0 |
0.822 |
0 |
0 |
0 |
0.000 |
| 21 |
26 |
|
[SO4]C:4103 |
4 |
1 |
185 |
◊ |
B |
-x,y,-z-1/2 |
3_554 |
3 |
1 |
23580 |
37.1 |
-4.2 |
0.693 |
1 |
0 |
0 |
0.000 |
| 22 |
27 |
|
D |
6 |
2 |
23056 |
◊ |
[SO4]C:4102 |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
3 |
1 |
185 |
33.8 |
-4.3 |
0.769 |
0 |
0 |
0 |
0.000 |
| 23 |
28 |
|
C |
6 |
4 |
23361 |
◊ |
B |
x,-y+1,-z |
4_565 |
6 |
2 |
23580 |
30.5 |
0.4 |
0.711 |
0 |
0 |
0 |
0.000 |
| 24 |
29 |
|
A |
2 |
1 |
23312 |
◊ |
[SO4]C:4103 |
x-1/2,-y+1/2,-z |
8_455 |
3 |
1 |
185 |
25.9 |
-3.1 |
0.479 |
0 |
0 |
0 |
0.030 |
| 25 |
30 |
|
D |
3 |
2 |
23056 |
◊ |
C |
-x,y,-z-1/2 |
3_554 |
3 |
2 |
23361 |
20.6 |
0.0 |
0.522 |
0 |
0 |
0 |
0.000 |
| 26 |
31 |
|
[SO4]B:4102 |
1 |
1 |
186 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
3 |
2 |
23312 |
12.0 |
-1.5 |
0.705 |
0 |
0 |
0 |
0.000 |
| 27 |
32 |
|
B |
1 |
1 |
23580 |
◊ |
C |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
2 |
2 |
23361 |
7.1 |
-0.0 |
0.583 |
0 |
0 |
0 |
0.000 |
| 28 |
33 |
|
[SO4]B:4102 |
1 |
1 |
186 |
◊ |
C |
x-1/2,-y+1/2,-z |
8_455 |
1 |
1 |
23361 |
3.4 |
-0.3 |
0.918 |
0 |
0 |
0 |
0.000 |
| 29 |
34 |
|
[SO4]C:4103 |
1 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
23056 |
0.7 |
-0.1 |
0.728 |
0 |
0 |
0 |
0.000 |
|