| ## |
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 |
213 |
48 |
8579 |
◊ |
A |
x,y,z |
1_555 |
196 |
49 |
8622 |
1868.9 |
-26.6 |
0.064 |
28 |
0 |
0 |
0.637 |
2 |
|
F |
195 |
48 |
8311 |
◊ |
E |
x,y,z |
1_555 |
193 |
43 |
8386 |
1782.8 |
-22.9 |
0.077 |
31 |
1 |
0 |
0.637 |
3 |
|
D |
183 |
44 |
8457 |
◊ |
B |
x,y,z |
1_555 |
188 |
45 |
8565 |
1721.1 |
-23.9 |
0.068 |
32 |
0 |
0 |
0.637 |
| Average: |
1790.9 |
-24.5 |
0.070 |
30 |
0 |
0 |
0.637 |
| 2 |
4 |
|
A |
53 |
16 |
8622 |
◊ |
F |
x,y,z-1 |
1_554 |
57 |
16 |
8311 |
559.1 |
-1.8 |
0.580 |
2 |
1 |
0 |
0.009 |
5 |
|
D |
54 |
16 |
8457 |
◊ |
C |
x-1,y-1,z |
1_445 |
58 |
16 |
8579 |
520.0 |
-1.6 |
0.591 |
4 |
0 |
0 |
0.009 |
6 |
|
B |
54 |
14 |
8565 |
◊ |
E |
x-1,y-1,z-1 |
1_444 |
54 |
16 |
8386 |
509.9 |
-1.7 |
0.579 |
5 |
0 |
0 |
0.009 |
| Average: |
529.6 |
-1.7 |
0.583 |
4 |
0 |
0 |
0.009 |
| 3 |
7 |
|
F |
40 |
10 |
8311 |
◊ |
E |
x,y-1,z |
1_545 |
36 |
8 |
8386 |
328.5 |
1.3 |
0.748 |
1 |
0 |
0 |
0.000 |
| 4 |
8 |
|
A |
22 |
9 |
8622 |
◊ |
E |
x-1,y-1,z-1 |
1_444 |
25 |
7 |
8386 |
233.5 |
-0.5 |
0.613 |
0 |
0 |
0 |
0.000 |
| 5 |
9 |
|
B |
26 |
6 |
8565 |
◊ |
A |
x-1,y,z |
1_455 |
21 |
5 |
8622 |
188.6 |
-3.3 |
0.253 |
0 |
0 |
0 |
0.000 |
| 6 |
10 |
|
F |
18 |
9 |
8311 |
◊ |
D |
x,y,z |
1_555 |
21 |
9 |
8457 |
160.5 |
1.1 |
0.732 |
1 |
0 |
0 |
0.000 |
11 |
|
E |
21 |
8 |
8386 |
◊ |
C |
x,y,z |
1_555 |
17 |
8 |
8579 |
154.4 |
2.3 |
0.800 |
2 |
0 |
0 |
0.000 |
| Average: |
157.5 |
1.7 |
0.766 |
2 |
0 |
0 |
0.000 |
| 7 |
12 |
|
E |
16 |
6 |
8386 |
◊ |
D |
x,y,z |
1_555 |
17 |
6 |
8457 |
152.0 |
0.6 |
0.712 |
0 |
2 |
0 |
0.000 |
13 |
|
E |
11 |
4 |
8386 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
8622 |
91.2 |
0.1 |
0.663 |
1 |
0 |
0 |
0.000 |
| Average: |
121.6 |
0.3 |
0.687 |
1 |
1 |
0 |
0.000 |
| 8 |
14 |
|
D |
22 |
7 |
8457 |
◊ |
E |
x-1,y-1,z |
1_445 |
17 |
7 |
8386 |
147.0 |
-0.9 |
0.504 |
0 |
0 |
0 |
0.000 |
15 |
|
A |
18 |
7 |
8622 |
◊ |
D |
x,y,z-1 |
1_554 |
12 |
8 |
8457 |
115.3 |
-0.6 |
0.582 |
0 |
2 |
0 |
0.000 |
| Average: |
131.2 |
-0.7 |
0.543 |
0 |
1 |
0 |
0.000 |
| 9 |
16 |
|
D |
14 |
4 |
8457 |
◊ |
E |
x-1,y,z |
1_455 |
17 |
4 |
8386 |
134.1 |
-2.0 |
0.341 |
0 |
2 |
0 |
0.000 |
| 10 |
17 |
|
F |
22 |
5 |
8311 |
◊ |
C |
x-1,y,z |
1_455 |
15 |
4 |
8579 |
133.5 |
1.7 |
0.730 |
0 |
0 |
0 |
0.000 |
| 11 |
18 |
|
B |
17 |
5 |
8565 |
◊ |
F |
x,y,z-1 |
1_554 |
19 |
5 |
8311 |
131.2 |
0.8 |
0.710 |
1 |
1 |
0 |
0.000 |
| 12 |
19 |
|
D |
14 |
5 |
8457 |
x |
D |
x-1,y,z |
1_455 |
14 |
3 |
8457 |
121.4 |
0.5 |
0.678 |
1 |
3 |
0 |
0.000 |
| 13 |
20 |
|
A |
14 |
4 |
8622 |
◊ |
E |
x-1,y,z-1 |
1_454 |
13 |
4 |
8386 |
120.3 |
0.1 |
0.642 |
0 |
0 |
0 |
0.000 |
| 14 |
21 |
|
B |
11 |
3 |
8565 |
◊ |
C |
x-1,y-1,z-1 |
1_444 |
10 |
4 |
8579 |
107.5 |
0.9 |
0.751 |
1 |
1 |
0 |
0.000 |
22 |
|
F |
7 |
3 |
8311 |
◊ |
C |
x-1,y-1,z |
1_445 |
7 |
3 |
8579 |
49.8 |
0.1 |
0.506 |
0 |
0 |
0 |
0.000 |
| Average: |
78.7 |
0.5 |
0.628 |
1 |
1 |
0 |
0.000 |
| 15 |
23 |
|
[SO4]B:137 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
8565 |
90.9 |
-11.5 |
0.895 |
2 |
0 |
0 |
0.157 |
| 16 |
24 |
|
[SO4]B:138 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
6 |
8565 |
88.6 |
-12.2 |
0.743 |
3 |
0 |
0 |
0.171 |
| 17 |
25 |
|
[SO4]F:137 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
7 |
4 |
8311 |
86.4 |
-12.4 |
0.825 |
4 |
0 |
0 |
0.245 |
| 18 |
26 |
|
[SO4]A:137 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
8622 |
81.1 |
-10.4 |
0.794 |
3 |
0 |
0 |
0.155 |
| 19 |
27 |
|
B |
10 |
6 |
8565 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
8622 |
79.9 |
-1.4 |
0.316 |
0 |
0 |
0 |
0.000 |
| 20 |
28 |
|
A |
10 |
2 |
8622 |
◊ |
F |
x-1,y,z-1 |
1_454 |
8 |
3 |
8311 |
76.3 |
0.2 |
0.491 |
0 |
0 |
0 |
0.000 |
| 21 |
29 |
|
D |
7 |
3 |
8457 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
8622 |
70.5 |
1.5 |
0.842 |
0 |
0 |
0 |
0.000 |
| 22 |
30 |
|
F |
9 |
3 |
8311 |
◊ |
C |
x,y,z |
1_555 |
12 |
3 |
8579 |
66.9 |
-0.6 |
0.526 |
0 |
0 |
0 |
0.000 |
31 |
|
F |
7 |
2 |
8311 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
8565 |
47.2 |
0.3 |
0.664 |
1 |
0 |
0 |
0.000 |
| Average: |
57.0 |
-0.2 |
0.595 |
1 |
0 |
0 |
0.000 |
| 23 |
32 |
|
[SO4]A:138 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
8622 |
66.7 |
-8.3 |
0.888 |
3 |
0 |
0 |
0.127 |
| 24 |
33 |
|
[SO4]D:137 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
8457 |
64.5 |
-7.4 |
0.912 |
3 |
0 |
0 |
0.111 |
| 25 |
34 |
|
[SO4]E:137 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
6 |
3 |
8386 |
63.2 |
-5.9 |
0.979 |
2 |
0 |
0 |
0.118 |
| 26 |
35 |
|
[SO4]A:139 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
8622 |
61.3 |
-7.3 |
0.878 |
1 |
0 |
0 |
0.102 |
| 27 |
36 |
|
C |
8 |
4 |
8579 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
8565 |
61.0 |
0.6 |
0.760 |
2 |
0 |
0 |
0.000 |
| 28 |
37 |
|
[SO4]A:139 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
8579 |
58.9 |
-7.6 |
0.775 |
0 |
0 |
0 |
0.101 |
| 29 |
38 |
|
B |
4 |
2 |
8565 |
◊ |
E |
x,y-1,z-1 |
1_544 |
6 |
4 |
8386 |
51.4 |
2.5 |
0.930 |
0 |
0 |
0 |
0.000 |
| 30 |
39 |
|
[SO4]B:138 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
8457 |
47.3 |
-6.1 |
0.749 |
0 |
0 |
0 |
0.077 |
| 31 |
40 |
|
B |
6 |
4 |
8565 |
◊ |
F |
x,y-1,z-1 |
1_544 |
8 |
2 |
8311 |
45.7 |
-0.0 |
0.627 |
0 |
0 |
0 |
0.000 |
| 32 |
41 |
|
D |
6 |
1 |
8457 |
◊ |
C |
x,y-1,z |
1_545 |
5 |
1 |
8579 |
44.7 |
-0.2 |
0.559 |
0 |
0 |
0 |
0.000 |
| 33 |
42 |
|
D |
5 |
2 |
8457 |
◊ |
F |
x-1,y,z |
1_455 |
6 |
2 |
8311 |
44.6 |
1.2 |
0.833 |
1 |
2 |
0 |
0.000 |
| 34 |
43 |
|
B |
8 |
4 |
8565 |
◊ |
[SO4]E:137 |
x-1,y-1,z-1 |
1_444 |
4 |
1 |
185 |
43.8 |
-5.3 |
0.834 |
3 |
0 |
0 |
0.015 |
| 35 |
44 |
|
[SO4]A:138 |
4 |
1 |
186 |
◊ |
E |
x-1,y-1,z-1 |
1_444 |
2 |
1 |
8386 |
40.6 |
-5.3 |
0.286 |
0 |
0 |
0 |
0.000 |
| 36 |
45 |
|
[SO4]D:137 |
3 |
1 |
184 |
◊ |
C |
x-1,y-1,z |
1_445 |
9 |
4 |
8579 |
38.1 |
-4.7 |
0.825 |
0 |
0 |
0 |
0.000 |
| 37 |
46 |
|
B |
4 |
1 |
8565 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
1 |
8579 |
34.2 |
0.8 |
0.802 |
2 |
3 |
0 |
0.000 |
47 |
|
D |
3 |
1 |
8457 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
8622 |
15.9 |
0.5 |
0.792 |
0 |
0 |
0 |
0.000 |
| Average: |
25.0 |
0.7 |
0.797 |
1 |
2 |
0 |
0.000 |
| 38 |
48 |
|
C |
2 |
1 |
8579 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
1 |
8622 |
15.7 |
0.7 |
0.831 |
0 |
0 |
0 |
0.000 |
| 39 |
49 |
|
[SO4]B:137 |
4 |
1 |
184 |
◊ |
E |
x-1,y-1,z-1 |
1_444 |
2 |
2 |
8386 |
11.3 |
-1.1 |
0.893 |
0 |
0 |
0 |
0.002 |
| 40 |
50 |
|
A |
1 |
1 |
8622 |
◊ |
[SO4]F:137 |
x,y,z-1 |
1_554 |
1 |
1 |
186 |
10.2 |
-1.2 |
0.809 |
0 |
0 |
0 |
0.000 |
| 41 |
51 |
|
[SO4]A:137 |
2 |
1 |
184 |
◊ |
F |
x,y,z-1 |
1_554 |
2 |
2 |
8311 |
4.4 |
-0.4 |
0.854 |
0 |
0 |
0 |
0.000 |
| 42 |
52 |
|
B |
1 |
1 |
8565 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
8457 |
3.4 |
-0.0 |
0.579 |
0 |
0 |
0 |
0.000 |
| 43 |
53 |
|
E |
1 |
1 |
8386 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
8579 |
0.7 |
0.0 |
0.724 |
0 |
0 |
0 |
0.000 |
|