| ## |
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 |
|
E |
254 |
68 |
14352 |
◊ |
C |
x,y,z |
1_555 |
235 |
63 |
14249 |
2444.3 |
-38.4 |
0.328 |
14 |
10 |
0 |
0.367 |
2 |
|
E |
231 |
67 |
14352 |
◊ |
A |
x,y,z |
1_555 |
231 |
61 |
14164 |
2404.7 |
-36.9 |
0.262 |
17 |
11 |
0 |
0.367 |
3 |
|
D |
237 |
65 |
14107 |
◊ |
C |
x,y,z |
1_555 |
244 |
64 |
14249 |
2390.8 |
-38.1 |
0.340 |
16 |
10 |
0 |
0.367 |
4 |
|
B |
238 |
64 |
14373 |
◊ |
A |
x,y,z |
1_555 |
221 |
64 |
14164 |
2388.9 |
-37.5 |
0.321 |
19 |
10 |
0 |
0.367 |
5 |
|
D |
230 |
63 |
14107 |
◊ |
B |
x,y,z |
1_555 |
232 |
62 |
14373 |
2338.8 |
-40.9 |
0.263 |
19 |
10 |
0 |
0.367 |
| Average: |
2393.5 |
-38.4 |
0.303 |
17 |
10 |
0 |
0.367 |
| 2 |
6 |
|
C |
38 |
12 |
14249 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
29 |
6 |
14373 |
323.4 |
-0.8 |
0.816 |
2 |
3 |
0 |
0.000 |
| 3 |
7 |
|
A |
32 |
9 |
14164 |
◊ |
C |
x-1/2,-y-1/2,-z |
4_445 |
40 |
13 |
14249 |
296.9 |
1.0 |
0.939 |
3 |
3 |
0 |
0.000 |
| 4 |
8 |
|
A |
29 |
7 |
14164 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
30 |
9 |
14107 |
255.9 |
-2.5 |
0.593 |
2 |
0 |
0 |
0.000 |
| 5 |
9 |
|
E |
32 |
10 |
14352 |
◊ |
C |
x-1/2,-y-1/2,-z |
4_445 |
27 |
8 |
14249 |
240.4 |
1.0 |
0.899 |
7 |
0 |
0 |
0.000 |
| 6 |
10 |
|
E |
24 |
7 |
14352 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
23 |
8 |
14373 |
202.2 |
-1.4 |
0.764 |
1 |
4 |
0 |
0.000 |
| 7 |
11 |
|
E |
17 |
4 |
14352 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
16 |
5 |
14107 |
117.0 |
-0.5 |
0.745 |
0 |
0 |
0 |
0.000 |
| 8 |
12 |
|
[ZN]C:301 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
11 |
4 |
14249 |
57.5 |
-37.7 |
0.000 |
0 |
0 |
0 |
0.292 |
13 |
|
[ZN]B:302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
14373 |
55.6 |
-36.1 |
0.000 |
0 |
0 |
0 |
0.292 |
14 |
|
[ZN]D:302 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
14107 |
52.8 |
-37.4 |
0.000 |
0 |
0 |
0 |
0.292 |
15 |
|
[ZN]E:302 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
8 |
5 |
14352 |
52.2 |
-38.4 |
0.000 |
0 |
0 |
0 |
0.292 |
16 |
|
[ZN]A:303 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
14164 |
50.9 |
-39.0 |
0.000 |
0 |
0 |
0 |
0.292 |
| Average: |
53.8 |
-37.7 |
0.000 |
0 |
0 |
0 |
0.292 |
| 9 |
17 |
|
[ZN]A:302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
14373 |
45.8 |
-22.6 |
0.000 |
0 |
0 |
0 |
0.176 |
18 |
|
[ZN]C:302 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
14249 |
45.5 |
-22.4 |
0.000 |
0 |
0 |
0 |
0.176 |
19 |
|
[ZN]E:301 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
9 |
5 |
14352 |
44.8 |
-22.5 |
0.000 |
0 |
0 |
0 |
0.176 |
20 |
|
[ZN]B:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
7 |
5 |
14107 |
44.2 |
-22.8 |
0.000 |
0 |
0 |
0 |
0.176 |
21 |
|
[ZN]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
14164 |
44.1 |
-23.4 |
0.000 |
0 |
0 |
0 |
0.176 |
| Average: |
44.9 |
-22.8 |
0.000 |
0 |
0 |
0 |
0.176 |
| 10 |
22 |
|
[ZN]B:301 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
14373 |
37.0 |
-16.8 |
0.000 |
0 |
0 |
0 |
0.130 |
23 |
|
[ZN]C:302 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
14107 |
36.7 |
-17.3 |
0.000 |
0 |
0 |
0 |
0.130 |
24 |
|
[ZN]A:302 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
14164 |
36.3 |
-16.9 |
0.000 |
0 |
0 |
0 |
0.130 |
25 |
|
[ZN]E:301 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
14249 |
35.7 |
-16.9 |
0.000 |
0 |
0 |
0 |
0.130 |
26 |
|
[ZN]A:301 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
14352 |
35.5 |
-16.2 |
0.000 |
0 |
0 |
0 |
0.130 |
| Average: |
36.2 |
-16.8 |
0.000 |
0 |
0 |
0 |
0.130 |
| 11 |
27 |
|
[ZN]D:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
4 |
1 |
14107 |
32.5 |
-15.4 |
0.000 |
0 |
0 |
0 |
0.024 |
| 12 |
28 |
|
E |
5 |
3 |
14352 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
4 |
2 |
14107 |
29.3 |
0.5 |
0.841 |
0 |
0 |
0 |
0.000 |
| 13 |
29 |
|
D |
4 |
2 |
14107 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
4 |
2 |
14373 |
28.9 |
0.4 |
0.844 |
0 |
1 |
0 |
0.000 |
| 14 |
30 |
|
[ZN]D:301 |
1 |
1 |
98 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
1 |
14373 |
28.1 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.008 |
| 15 |
31 |
|
B |
1 |
1 |
14373 |
x |
B |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
14373 |
15.9 |
0.4 |
0.436 |
0 |
0 |
0 |
0.000 |
| 16 |
32 |
|
[ZN]D:301 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
14373 |
15.1 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.010 |
| 17 |
33 |
|
C |
2 |
2 |
14249 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
14373 |
6.4 |
-0.2 |
0.512 |
0 |
0 |
0 |
0.001 |
34 |
|
D |
2 |
2 |
14107 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
14164 |
4.2 |
-0.1 |
0.566 |
0 |
0 |
0 |
0.001 |
35 |
|
E |
3 |
2 |
14352 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
14373 |
4.0 |
-0.1 |
0.655 |
0 |
0 |
0 |
0.001 |
36 |
|
E |
2 |
2 |
14352 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
14107 |
3.5 |
-0.1 |
0.622 |
0 |
0 |
0 |
0.001 |
37 |
|
C |
1 |
1 |
14249 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
14164 |
2.7 |
-0.1 |
0.453 |
0 |
0 |
0 |
0.001 |
| Average: |
4.2 |
-0.1 |
0.561 |
0 |
0 |
0 |
0.001 |
| 18 |
38 |
|
A |
1 |
1 |
14164 |
◊ |
[ZN]D:302 |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
98 |
3.6 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
|