| ## |
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 |
62 |
20 |
7804 |
◊ |
A |
x-1/2,-y+3/2,-z |
3_465 |
63 |
21 |
7772 |
539.5 |
-4.1 |
0.443 |
2 |
0 |
0 |
0.000 |
| 2 |
2 |
|
A |
43 |
13 |
7772 |
◊ |
B |
x-1/2,-y+3/2,-z |
3_465 |
41 |
12 |
7804 |
389.7 |
-4.0 |
0.313 |
1 |
0 |
0 |
0.000 |
| 3 |
3 |
|
[2RQ]A:201 |
28 |
1 |
619 |
f |
A |
x,y,z |
1_555 |
46 |
19 |
7772 |
383.5 |
-4.5 |
0.267 |
1 |
0 |
0 |
0.430 |
4 |
|
[2RQ]B:201 |
29 |
1 |
615 |
f |
B |
x,y,z |
1_555 |
48 |
19 |
7804 |
381.7 |
-4.5 |
0.305 |
2 |
0 |
0 |
0.430 |
| Average: |
382.6 |
-4.5 |
0.286 |
2 |
0 |
0 |
0.430 |
| 4 |
5 |
|
B |
33 |
10 |
7804 |
◊ |
A |
x,y,z |
1_555 |
34 |
10 |
7772 |
347.5 |
-1.1 |
0.369 |
4 |
6 |
0 |
0.000 |
| 5 |
6 |
|
A |
27 |
9 |
7772 |
◊ |
B |
x,y-1,z |
1_545 |
36 |
10 |
7804 |
285.3 |
-1.8 |
0.279 |
0 |
0 |
0 |
0.000 |
| 6 |
7 |
|
B |
22 |
8 |
7804 |
x |
B |
x-1,y,z |
1_455 |
19 |
6 |
7804 |
192.2 |
-2.8 |
0.203 |
1 |
0 |
0 |
0.000 |
| 7 |
8 |
|
A |
18 |
4 |
7772 |
◊ |
B |
-x+3,y-1/2,-z+1/2 |
4_845 |
24 |
6 |
7804 |
170.0 |
-3.0 |
0.236 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[EDO]B:202 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
7804 |
99.6 |
2.7 |
0.479 |
1 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[EDO]A:202 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
15 |
8 |
7772 |
99.4 |
2.7 |
0.469 |
1 |
0 |
0 |
0.000 |
| 10 |
11 |
|
[EDO]B:206 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
17 |
6 |
7804 |
98.2 |
2.5 |
0.426 |
0 |
0 |
0 |
0.000 |
| 11 |
12 |
|
[EDO]B:204 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
7804 |
93.4 |
2.7 |
0.429 |
1 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[2RQ]A:201 |
11 |
1 |
619 |
◊ |
B |
-x+3,y-1/2,-z+1/2 |
4_845 |
8 |
3 |
7804 |
91.4 |
-1.4 |
0.398 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
A |
8 |
3 |
7772 |
◊ |
[2RQ]B:201 |
-x+3,y-1/2,-z+1/2 |
4_845 |
10 |
1 |
615 |
88.3 |
-1.2 |
0.409 |
0 |
0 |
0 |
0.000 |
| 14 |
15 |
|
A |
12 |
4 |
7772 |
◊ |
[EDO]B:203 |
-x+3,y-1/2,-z+1/2 |
4_845 |
4 |
1 |
183 |
82.2 |
1.9 |
0.326 |
0 |
0 |
0 |
0.000 |
| 15 |
16 |
|
[EDO]B:205 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
7804 |
80.4 |
2.4 |
0.296 |
1 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[EDO]B:205 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
7772 |
72.0 |
1.9 |
0.861 |
2 |
0 |
0 |
0.000 |
| 17 |
18 |
|
[2RQ]A:201 |
5 |
1 |
619 |
◊ |
[2RQ]B:201 |
-x+3,y-1/2,-z+1/2 |
4_845 |
7 |
1 |
615 |
57.2 |
-1.8 |
0.319 |
0 |
0 |
0 |
0.000 |
| 18 |
19 |
|
[CL]A:203 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
7772 |
54.0 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.070 |
| 19 |
20 |
|
[EDO]B:203 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
7804 |
49.3 |
0.5 |
0.766 |
2 |
0 |
0 |
0.028 |
| 20 |
21 |
|
B |
5 |
1 |
7804 |
◊ |
A |
x-1,y+1,z |
1_465 |
4 |
1 |
7772 |
44.8 |
0.3 |
0.692 |
0 |
1 |
0 |
0.000 |
| 21 |
22 |
|
[EDO]B:204 |
3 |
1 |
184 |
f |
A |
x-1/2,-y+3/2,-z |
3_465 |
5 |
3 |
7772 |
43.8 |
0.3 |
0.465 |
0 |
0 |
0 |
0.000 |
| 22 |
23 |
|
A |
6 |
1 |
7772 |
x |
A |
x-1,y,z |
1_455 |
3 |
2 |
7772 |
40.5 |
-0.7 |
0.248 |
0 |
0 |
0 |
0.000 |
| 23 |
24 |
|
A |
2 |
1 |
7772 |
f |
[EDO]B:206 |
x,y-1,z |
1_545 |
3 |
1 |
183 |
38.0 |
0.6 |
0.272 |
0 |
0 |
0 |
0.000 |
| 24 |
25 |
|
[EDO]A:202 |
3 |
1 |
184 |
f |
B |
x,y-1,z |
1_545 |
5 |
2 |
7804 |
35.5 |
1.5 |
0.902 |
0 |
0 |
0 |
0.000 |
| 25 |
26 |
|
[EDO]B:203 |
3 |
1 |
183 |
f |
[2RQ]B:201 |
x,y,z |
1_555 |
3 |
1 |
615 |
29.8 |
0.7 |
0.831 |
0 |
0 |
0 |
0.000 |
| 26 |
27 |
|
A |
3 |
1 |
7772 |
◊ |
B |
x-1,y,z |
1_455 |
4 |
1 |
7804 |
28.8 |
0.7 |
0.831 |
0 |
1 |
0 |
0.000 |
| 27 |
28 |
|
B |
3 |
2 |
7804 |
x |
B |
x-1/2,-y+5/2,-z |
3_475 |
3 |
2 |
7804 |
18.3 |
-0.0 |
0.625 |
0 |
0 |
0 |
0.000 |
| 28 |
29 |
|
[CL]A:203 |
1 |
1 |
125 |
◊ |
[2RQ]B:201 |
-x+3,y-1/2,-z+1/2 |
4_845 |
3 |
1 |
615 |
11.4 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 29 |
30 |
|
A |
3 |
1 |
7772 |
◊ |
B |
-x+2,y-1/2,-z+1/2 |
4_745 |
1 |
1 |
7804 |
4.8 |
0.1 |
0.711 |
0 |
0 |
0 |
0.000 |
|