| ## |
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 |
|
B |
123 |
30 |
6763 |
◊ |
A |
x,y,z |
1_555 |
141 |
43 |
15547 |
1276.9 |
-13.0 |
0.178 |
17 |
5 |
0 |
0.428 |
2 |
|
D |
122 |
29 |
6503 |
◊ |
C |
x,y,z |
1_555 |
128 |
41 |
15814 |
1147.6 |
-8.8 |
0.287 |
18 |
5 |
0 |
0.428 |
| Average: |
1212.2 |
-10.9 |
0.233 |
18 |
5 |
0 |
0.428 |
| 2 |
3 |
|
E |
60 |
9 |
1408 |
◊ |
A |
x,y,z |
1_555 |
114 |
35 |
15547 |
817.3 |
-6.8 |
0.453 |
19 |
0 |
0 |
0.623 |
4 |
|
F |
58 |
9 |
1404 |
◊ |
C |
x,y,z |
1_555 |
112 |
35 |
15814 |
810.5 |
-6.8 |
0.426 |
19 |
0 |
0 |
0.623 |
| Average: |
813.9 |
-6.8 |
0.439 |
19 |
0 |
0 |
0.623 |
| 3 |
5 |
|
C |
89 |
21 |
15814 |
◊ |
A |
x,y,z |
1_555 |
90 |
22 |
15547 |
712.3 |
-1.7 |
0.621 |
6 |
11 |
0 |
0.000 |
| 4 |
6 |
|
A |
66 |
20 |
15547 |
◊ |
C |
x,y-1,z |
1_545 |
69 |
20 |
15814 |
551.4 |
-0.3 |
0.658 |
5 |
1 |
0 |
0.000 |
| 5 |
7 |
|
B |
42 |
10 |
6763 |
◊ |
A |
-x,y,-z |
2_555 |
47 |
14 |
15547 |
406.4 |
-1.1 |
0.578 |
5 |
1 |
0 |
0.093 |
8 |
|
D |
37 |
9 |
6503 |
◊ |
C |
-x,y,-z+1 |
2_556 |
47 |
13 |
15814 |
366.5 |
-2.2 |
0.471 |
5 |
1 |
0 |
0.093 |
| Average: |
386.5 |
-1.7 |
0.525 |
5 |
1 |
0 |
0.093 |
| 6 |
9 |
|
B |
28 |
9 |
6763 |
◊ |
B |
-x+1,y,-z |
2_655 |
28 |
9 |
6763 |
289.6 |
-1.7 |
0.558 |
0 |
0 |
0 |
0.000 |
| 7 |
10 |
|
C |
31 |
10 |
15814 |
◊ |
C |
-x,y,-z+1 |
2_556 |
31 |
10 |
15814 |
277.7 |
-4.2 |
0.190 |
8 |
0 |
0 |
0.078 |
11 |
|
A |
31 |
11 |
15547 |
◊ |
A |
-x,y,-z |
2_555 |
31 |
11 |
15547 |
264.9 |
-2.0 |
0.431 |
2 |
0 |
0 |
0.078 |
| Average: |
271.3 |
-3.1 |
0.310 |
5 |
0 |
0 |
0.078 |
| 8 |
12 |
|
E |
14 |
4 |
1408 |
◊ |
C |
x,y-1,z |
1_545 |
22 |
9 |
15814 |
179.2 |
-1.4 |
0.479 |
2 |
1 |
0 |
0.000 |
13 |
|
A |
22 |
9 |
15547 |
◊ |
F |
x,y-1,z |
1_545 |
15 |
4 |
1404 |
177.4 |
-1.2 |
0.510 |
2 |
2 |
0 |
0.000 |
| Average: |
178.3 |
-1.3 |
0.494 |
2 |
2 |
0 |
0.000 |
| 9 |
14 |
|
B |
25 |
7 |
6763 |
◊ |
C |
x,y,z-1 |
1_554 |
21 |
9 |
15814 |
170.9 |
-2.1 |
0.351 |
2 |
0 |
0 |
0.078 |
15 |
|
A |
20 |
9 |
15547 |
◊ |
D |
x,y,z-1 |
1_554 |
23 |
7 |
6503 |
168.6 |
-2.2 |
0.333 |
2 |
0 |
0 |
0.078 |
| Average: |
169.8 |
-2.1 |
0.342 |
2 |
0 |
0 |
0.078 |
| 10 |
16 |
|
B |
19 |
6 |
6763 |
◊ |
D |
x,y,z-1 |
1_554 |
19 |
6 |
6503 |
158.0 |
0.9 |
0.772 |
4 |
3 |
0 |
0.010 |
| 11 |
17 |
|
E |
13 |
4 |
1408 |
◊ |
F |
x,y-1,z |
1_545 |
12 |
4 |
1404 |
115.1 |
-0.2 |
0.665 |
2 |
0 |
0 |
0.000 |
| 12 |
18 |
|
B |
11 |
2 |
6763 |
◊ |
B |
-x,y,-z |
2_555 |
11 |
2 |
6763 |
104.2 |
-2.8 |
0.182 |
0 |
0 |
0 |
0.017 |
19 |
|
D |
4 |
1 |
6503 |
◊ |
D |
-x,y,-z+1 |
2_556 |
4 |
1 |
6503 |
17.1 |
0.3 |
0.707 |
0 |
0 |
0 |
0.017 |
| Average: |
60.7 |
-1.3 |
0.445 |
0 |
0 |
0 |
0.017 |
| 13 |
20 |
|
[SO4]B:101 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
6763 |
81.5 |
-10.5 |
0.861 |
2 |
0 |
0 |
0.155 |
| 14 |
21 |
|
D |
8 |
3 |
6503 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
9 |
4 |
15547 |
80.1 |
0.1 |
0.573 |
2 |
0 |
0 |
0.000 |
| 15 |
22 |
|
[SO4]C:301 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
8 |
3 |
15814 |
64.9 |
-7.9 |
0.918 |
3 |
0 |
0 |
0.377 |
| 16 |
23 |
|
[SO4]D:101 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
12 |
4 |
6503 |
64.8 |
-8.4 |
0.799 |
1 |
0 |
0 |
0.227 |
| 17 |
24 |
|
[SO4]A:301 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
15547 |
62.8 |
-8.2 |
0.876 |
4 |
0 |
0 |
0.293 |
| 18 |
25 |
|
[SO4]A:302 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
15547 |
62.6 |
-7.5 |
0.908 |
3 |
0 |
0 |
0.259 |
| 19 |
26 |
|
[SO4]A:303 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
6763 |
60.5 |
-8.8 |
0.656 |
1 |
0 |
0 |
0.126 |
| 20 |
27 |
|
A |
6 |
3 |
15547 |
◊ |
[SO4]D:101 |
x,y,z-1 |
1_554 |
4 |
1 |
185 |
57.8 |
-8.0 |
0.543 |
1 |
0 |
0 |
0.215 |
| 21 |
28 |
|
[SO4]C:301 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
6503 |
45.3 |
-5.4 |
0.673 |
0 |
0 |
0 |
0.132 |
| 22 |
29 |
|
[SO4]A:302 |
4 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
6763 |
45.0 |
-5.2 |
0.808 |
1 |
0 |
0 |
0.077 |
| 23 |
30 |
|
[SO4]A:301 |
3 |
1 |
185 |
◊ |
B |
-x,y,-z |
2_555 |
7 |
4 |
6763 |
44.1 |
-5.4 |
0.886 |
0 |
0 |
0 |
0.064 |
| 24 |
31 |
|
[SO4]A:303 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
15547 |
43.9 |
-4.0 |
0.973 |
2 |
0 |
0 |
0.067 |
| 25 |
32 |
|
C |
3 |
1 |
15814 |
◊ |
A |
-x+1,y,-z+1 |
2_656 |
2 |
1 |
15547 |
22.5 |
-0.7 |
0.217 |
0 |
0 |
0 |
0.000 |
| 26 |
33 |
|
[SO4]B:101 |
2 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
15547 |
17.4 |
-2.1 |
0.765 |
0 |
0 |
0 |
0.029 |
| 27 |
34 |
|
C |
5 |
5 |
15814 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
5 |
5 |
15814 |
12.9 |
0.6 |
0.780 |
0 |
0 |
0 |
0.000 |
| 28 |
35 |
|
D |
4 |
2 |
6503 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
2 |
1 |
15814 |
12.3 |
0.0 |
0.609 |
0 |
0 |
0 |
0.000 |
|