| ## |
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 |
235 |
59 |
17122 |
◊ |
A |
x,y,z |
1_555 |
234 |
58 |
17256 |
2069.0 |
-17.5 |
0.251 |
30 |
9 |
0 |
0.351 |
| 2 |
2 |
|
A |
58 |
16 |
17256 |
◊ |
B |
-x+2,y-1/2,-z+2 |
2_747 |
60 |
19 |
17122 |
531.8 |
1.9 |
0.832 |
8 |
3 |
0 |
0.000 |
| 3 |
3 |
|
B |
39 |
12 |
17122 |
◊ |
A |
x-1,y,z |
1_455 |
39 |
12 |
17256 |
347.3 |
1.4 |
0.803 |
3 |
2 |
0 |
0.000 |
| 4 |
4 |
|
A |
38 |
13 |
17256 |
◊ |
B |
-x+1,y-1/2,-z+2 |
2_647 |
34 |
14 |
17122 |
270.9 |
-0.5 |
0.619 |
4 |
1 |
0 |
0.000 |
| 5 |
5 |
|
B |
29 |
9 |
17122 |
◊ |
A |
x-1,y,z-1 |
1_454 |
29 |
10 |
17256 |
202.5 |
-0.1 |
0.672 |
2 |
0 |
0 |
0.000 |
| 6 |
6 |
|
[FEO]B:400 |
3 |
1 |
210 |
f |
B |
x,y,z |
1_555 |
13 |
9 |
17122 |
110.5 |
-20.6 |
0.348 |
0 |
0 |
0 |
0.442 |
7 |
|
[FEO]A:401 |
3 |
1 |
209 |
f |
A |
x,y,z |
1_555 |
13 |
9 |
17256 |
107.4 |
-19.9 |
0.297 |
0 |
0 |
0 |
0.442 |
| Average: |
108.9 |
-20.2 |
0.323 |
0 |
0 |
0 |
0.442 |
| 7 |
8 |
|
[EDO]B:401 |
3 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
20 |
7 |
17122 |
85.5 |
2.2 |
0.518 |
1 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[EDO]A:403 |
3 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
17 |
7 |
17256 |
84.7 |
1.8 |
0.244 |
1 |
0 |
0 |
0.000 |
| 9 |
10 |
|
B |
15 |
6 |
17122 |
f |
[EDO]A:402 |
x-1,y,z-1 |
1_454 |
4 |
1 |
185 |
75.5 |
1.1 |
0.693 |
0 |
0 |
0 |
0.000 |
| 10 |
11 |
|
[CL]A:400 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
17256 |
72.3 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.264 |
12 |
|
[CL]B:399 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
17122 |
71.1 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.264 |
| Average: |
71.7 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.264 |
| 11 |
13 |
|
[EDO]A:402 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
17256 |
68.3 |
1.5 |
0.223 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
[EDO]A:403 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
17122 |
68.0 |
1.0 |
0.563 |
0 |
0 |
0 |
0.000 |
| 13 |
15 |
|
[EDO]B:401 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
17256 |
63.2 |
0.6 |
0.535 |
1 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[CL]A:399 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
17256 |
51.2 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.119 |
17 |
|
[CL]A:399 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
17122 |
50.3 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.119 |
| Average: |
50.7 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.119 |
| 15 |
18 |
|
B |
9 |
2 |
17122 |
x |
B |
-x+1,y-1/2,-z+2 |
2_647 |
5 |
1 |
17122 |
48.0 |
0.6 |
0.718 |
0 |
0 |
0 |
0.000 |
| 16 |
19 |
|
B |
5 |
3 |
17122 |
x |
B |
x-1,y,z |
1_455 |
3 |
1 |
17122 |
43.8 |
-0.5 |
0.240 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
A |
2 |
1 |
17256 |
x |
A |
x-1,y,z |
1_455 |
2 |
1 |
17256 |
16.3 |
0.4 |
0.728 |
0 |
0 |
0 |
0.000 |
| 18 |
21 |
|
A |
1 |
1 |
17256 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
17122 |
15.5 |
0.4 |
0.564 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
[FEO]A:401 |
3 |
1 |
209 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
17122 |
6.3 |
-0.2 |
0.907 |
0 |
0 |
0 |
0.002 |
|