| ## |
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 |
87 |
22 |
13532 |
x |
B |
x-1,y,z |
1_455 |
90 |
24 |
13532 |
830.9 |
-1.9 |
0.417 |
11 |
3 |
0 |
0.000 |
2 |
|
A |
92 |
25 |
13565 |
x |
A |
x-1,y,z |
1_455 |
84 |
20 |
13565 |
827.5 |
-2.2 |
0.418 |
12 |
3 |
0 |
0.000 |
| Average: |
829.2 |
-2.1 |
0.418 |
12 |
3 |
0 |
0.000 |
| 2 |
3 |
|
[03I]B:405 |
31 |
1 |
760 |
f |
B |
x,y,z |
1_555 |
61 |
25 |
13532 |
482.6 |
-4.9 |
0.209 |
5 |
0 |
0 |
0.104 |
4 |
|
[03I]A:405 |
31 |
1 |
761 |
f |
A |
x,y,z |
1_555 |
62 |
26 |
13565 |
480.4 |
-5.2 |
0.196 |
5 |
0 |
0 |
0.104 |
| Average: |
481.5 |
-5.1 |
0.203 |
5 |
0 |
0 |
0.104 |
| 3 |
5 |
|
A |
41 |
10 |
13565 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
46 |
11 |
13532 |
392.1 |
2.5 |
0.759 |
9 |
16 |
0 |
0.000 |
| 4 |
6 |
|
A |
29 |
11 |
13565 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
34 |
12 |
13565 |
267.6 |
-1.1 |
0.432 |
1 |
0 |
0 |
0.000 |
| 5 |
7 |
|
B |
29 |
9 |
13532 |
x |
B |
x-1/2,-y+3/2,-z |
4_465 |
30 |
10 |
13532 |
239.3 |
0.6 |
0.545 |
2 |
0 |
0 |
0.000 |
| 6 |
8 |
|
B |
28 |
10 |
13532 |
◊ |
A |
x,y,z |
1_555 |
26 |
14 |
13565 |
214.8 |
0.1 |
0.536 |
1 |
0 |
0 |
0.000 |
| 7 |
9 |
|
B |
19 |
6 |
13532 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
21 |
6 |
13532 |
177.4 |
0.4 |
0.607 |
0 |
3 |
0 |
0.000 |
| 8 |
10 |
|
A |
19 |
6 |
13565 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
21 |
7 |
13532 |
173.3 |
-1.2 |
0.385 |
2 |
4 |
0 |
0.019 |
| 9 |
11 |
|
A |
18 |
6 |
13565 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
20 |
5 |
13565 |
141.3 |
1.8 |
0.698 |
2 |
4 |
0 |
0.000 |
| 10 |
12 |
|
A |
16 |
6 |
13565 |
◊ |
B |
x,y-1,z |
1_545 |
15 |
5 |
13532 |
120.8 |
-1.1 |
0.369 |
1 |
0 |
0 |
0.000 |
| 11 |
13 |
|
B |
7 |
3 |
13532 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
9 |
4 |
13565 |
61.7 |
2.5 |
0.907 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
A |
10 |
4 |
13565 |
◊ |
B |
x-1,y-1,z |
1_445 |
5 |
1 |
13532 |
52.0 |
1.1 |
0.683 |
0 |
0 |
0 |
0.000 |
| 13 |
15 |
|
[03I]A:405 |
3 |
1 |
761 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
13532 |
40.3 |
-0.6 |
0.517 |
0 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[ZN]B:400 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
13532 |
36.8 |
-27.1 |
0.000 |
0 |
0 |
0 |
0.386 |
17 |
|
[ZN]A:400 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
13565 |
36.7 |
-26.9 |
0.000 |
0 |
0 |
0 |
0.386 |
| Average: |
36.7 |
-27.0 |
0.000 |
0 |
0 |
0 |
0.386 |
| 15 |
18 |
|
[ZN]B:300 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
13532 |
36.0 |
-20.0 |
0.000 |
0 |
0 |
0 |
0.276 |
19 |
|
A |
6 |
3 |
13565 |
◊ |
[ZN]B:300 |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
98 |
35.5 |
-18.5 |
0.000 |
0 |
0 |
0 |
0.276 |
| Average: |
35.8 |
-19.3 |
0.000 |
0 |
0 |
0 |
0.276 |
| 16 |
20 |
|
[03I]B:405 |
6 |
1 |
760 |
f |
[ZN]B:400 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.6 |
-14.9 |
0.000 |
0 |
0 |
0 |
0.214 |
21 |
|
[03I]A:405 |
5 |
1 |
761 |
f |
[ZN]A:400 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.5 |
-15.1 |
0.000 |
0 |
0 |
0 |
0.214 |
| Average: |
31.6 |
-15.0 |
0.000 |
0 |
0 |
0 |
0.214 |
| 17 |
22 |
|
[03I]B:405 |
3 |
1 |
760 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
2 |
2 |
13532 |
14.3 |
-0.4 |
0.435 |
0 |
0 |
0 |
0.000 |
| 18 |
23 |
|
A |
3 |
3 |
13565 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
2 |
13532 |
10.6 |
-0.0 |
0.526 |
0 |
0 |
0 |
0.000 |
|