| ## |
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 |
70 |
16 |
6760 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
79 |
19 |
6650 |
711.4 |
-5.7 |
0.435 |
9 |
0 |
0 |
0.017 |
| 2 |
2 |
|
A |
48 |
13 |
6760 |
◊ |
B |
-x+2,y-1/2,-z+1/2 |
3_745 |
51 |
13 |
6650 |
509.1 |
-1.8 |
0.611 |
3 |
0 |
0 |
0.053 |
| 3 |
3 |
|
B |
42 |
14 |
6650 |
◊ |
A |
x,y,z |
1_555 |
45 |
15 |
6760 |
413.2 |
2.4 |
0.853 |
5 |
0 |
0 |
0.000 |
| 4 |
4 |
|
A |
41 |
12 |
6760 |
◊ |
B |
-x+3/2,-y+2,z-1/2 |
2_674 |
39 |
12 |
6650 |
358.5 |
-5.1 |
0.263 |
4 |
3 |
0 |
0.013 |
| 5 |
5 |
|
B |
46 |
13 |
6650 |
◊ |
A |
x-1,y,z |
1_455 |
32 |
8 |
6760 |
355.1 |
-1.1 |
0.634 |
3 |
0 |
0 |
0.000 |
| 6 |
6 |
|
[R78]B:201 |
26 |
1 |
621 |
◊ |
B |
x,y,z |
1_555 |
31 |
12 |
6650 |
282.8 |
0.9 |
0.271 |
1 |
0 |
0 |
0.000 |
7 |
|
[R78]A:201 |
26 |
1 |
605 |
◊ |
A |
x,y,z |
1_555 |
32 |
12 |
6760 |
278.6 |
1.5 |
0.326 |
1 |
0 |
0 |
0.000 |
| Average: |
280.7 |
1.2 |
0.299 |
1 |
0 |
0 |
0.000 |
| 7 |
8 |
|
[GOL]A:202 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
6760 |
110.7 |
-0.3 |
0.543 |
2 |
0 |
0 |
0.019 |
| 8 |
9 |
|
[R78]A:201 |
6 |
1 |
605 |
f |
[R78]B:201 |
-x+3/2,-y+2,z-1/2 |
2_674 |
8 |
1 |
621 |
85.3 |
-2.5 |
0.107 |
0 |
0 |
0 |
0.100 |
| 9 |
10 |
|
[SO4]B:202 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
6760 |
69.6 |
-9.3 |
0.802 |
3 |
0 |
0 |
0.179 |
| 10 |
11 |
|
[SO4]B:203 |
4 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
6650 |
68.1 |
-9.3 |
0.791 |
3 |
0 |
0 |
0.179 |
| 11 |
12 |
|
[UNX]B:206 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
6650 |
66.1 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.150 |
13 |
|
[UNX]A:204 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
6760 |
55.7 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.150 |
| Average: |
60.9 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.150 |
| 12 |
14 |
|
[UNX]B:208 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
6650 |
65.8 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.090 |
| 13 |
15 |
|
[UNX]A:203 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
6760 |
64.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.075 |
| 14 |
16 |
|
[GOL]A:202 |
5 |
1 |
218 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
6650 |
61.8 |
-0.0 |
0.558 |
1 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[UNX]A:205 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
6760 |
57.9 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.069 |
| 16 |
18 |
|
[UNX]B:207 |
1 |
1 |
129 |
◊ |
B |
x,y,z |
1_555 |
9 |
5 |
6650 |
57.3 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.048 |
19 |
|
A |
4 |
3 |
6760 |
◊ |
[UNX]B:207 |
-x+2,y-1/2,-z+1/2 |
3_745 |
1 |
1 |
129 |
46.1 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.048 |
| Average: |
51.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.048 |
| 17 |
20 |
|
[UNX]B:205 |
1 |
1 |
129 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
6650 |
54.1 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.125 |
21 |
|
A |
14 |
6 |
6760 |
◊ |
[UNX]B:205 |
-x+2,y-1/2,-z+1/2 |
3_745 |
1 |
1 |
129 |
52.4 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.125 |
| Average: |
53.3 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.125 |
| 18 |
22 |
|
[R78]A:201 |
4 |
1 |
605 |
◊ |
B |
-x+3/2,-y+2,z-1/2 |
2_674 |
7 |
2 |
6650 |
49.1 |
-1.1 |
0.256 |
0 |
0 |
0 |
0.000 |
23 |
|
A |
7 |
2 |
6760 |
◊ |
[R78]B:201 |
-x+3/2,-y+2,z-1/2 |
2_674 |
4 |
1 |
621 |
47.3 |
-1.1 |
0.305 |
0 |
0 |
0 |
0.000 |
| Average: |
48.2 |
-1.1 |
0.281 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
[UNX]B:204 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
6650 |
39.9 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.037 |
| 20 |
25 |
|
[SO4]B:202 |
3 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
6650 |
34.3 |
-3.5 |
0.928 |
1 |
0 |
0 |
0.000 |
| 21 |
26 |
|
[UNX]A:204 |
1 |
1 |
129 |
◊ |
B |
-x+3/2,-y+2,z-1/2 |
2_674 |
3 |
1 |
6650 |
32.6 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.005 |
27 |
|
A |
2 |
1 |
6760 |
◊ |
[UNX]B:206 |
-x+3/2,-y+2,z-1/2 |
2_674 |
1 |
1 |
129 |
12.6 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.005 |
| Average: |
22.6 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.005 |
| 22 |
28 |
|
A |
5 |
2 |
6760 |
x |
A |
x-1,y,z |
1_455 |
7 |
3 |
6760 |
29.1 |
-0.0 |
0.628 |
0 |
0 |
0 |
0.000 |
29 |
|
B |
2 |
2 |
6650 |
x |
B |
x-1,y,z |
1_455 |
3 |
1 |
6650 |
20.7 |
-0.0 |
0.527 |
0 |
0 |
0 |
0.000 |
| Average: |
24.9 |
-0.0 |
0.578 |
0 |
0 |
0 |
0.000 |
| 23 |
30 |
|
[UNX]A:205 |
1 |
1 |
129 |
◊ |
[R78]A:201 |
x,y,z |
1_555 |
7 |
1 |
605 |
26.1 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 24 |
31 |
|
A |
3 |
2 |
6760 |
◊ |
[UNX]B:208 |
-x+2,y-1/2,-z+1/2 |
3_745 |
1 |
1 |
129 |
19.5 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.019 |
| 25 |
32 |
|
[UNX]A:205 |
1 |
1 |
129 |
◊ |
[R78]B:201 |
-x+3/2,-y+2,z-1/2 |
2_674 |
1 |
1 |
621 |
15.8 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 26 |
33 |
|
[UNX]B:208 |
1 |
1 |
129 |
◊ |
[UNX]B:207 |
x,y,z |
1_555 |
1 |
1 |
129 |
9.0 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.014 |
| 27 |
34 |
|
B |
3 |
1 |
6650 |
◊ |
[GOL]A:202 |
x-1,y,z |
1_455 |
2 |
1 |
218 |
4.8 |
-0.1 |
0.576 |
0 |
0 |
0 |
0.000 |
| 28 |
35 |
|
[SO4]B:203 |
1 |
1 |
188 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
1 |
6760 |
4.5 |
-0.5 |
0.731 |
0 |
0 |
0 |
0.000 |
| 29 |
36 |
|
[UNX]B:208 |
1 |
1 |
129 |
◊ |
[UNX]B:205 |
x,y,z |
1_555 |
1 |
1 |
129 |
2.7 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.005 |
|