## |
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 |
96 |
31 |
9711 |
◊ |
A |
x,y,z |
1_555 |
93 |
31 |
9899 |
886.1 |
-6.6 |
0.365 |
5 |
2 |
0 |
0.042 |
2 |
2 |
|
A |
50 |
10 |
9899 |
◊ |
B |
x,y-1,z |
1_545 |
56 |
14 |
9711 |
438.9 |
3.0 |
0.879 |
3 |
0 |
0 |
0.000 |
3 |
3 |
|
B |
33 |
11 |
9711 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
36 |
10 |
9899 |
349.8 |
0.3 |
0.598 |
4 |
0 |
0 |
0.000 |
4 |
4 |
|
B |
32 |
9 |
9711 |
x |
B |
-x-1/2,-y+1,z-1/2 |
2_464 |
30 |
8 |
9711 |
305.6 |
-1.6 |
0.482 |
4 |
0 |
0 |
0.000 |
5 |
5 |
|
A |
28 |
12 |
9899 |
◊ |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
29 |
9 |
9711 |
263.6 |
-1.0 |
0.564 |
1 |
0 |
0 |
0.000 |
6 |
6 |
|
[HCH]A:305 |
16 |
1 |
388 |
f |
A |
x,y,z |
1_555 |
30 |
12 |
9899 |
228.3 |
-3.6 |
0.273 |
6 |
0 |
0 |
0.029 |
7 |
7 |
|
A |
22 |
9 |
9899 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
36 |
11 |
9711 |
225.7 |
-1.9 |
0.426 |
2 |
1 |
0 |
0.000 |
8 |
8 |
|
[HCH]B:305 |
16 |
1 |
399 |
f |
B |
x,y,z |
1_555 |
31 |
13 |
9711 |
221.7 |
-0.8 |
0.591 |
7 |
0 |
0 |
0.018 |
9 |
9 |
|
A |
16 |
8 |
9899 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
25 |
5 |
9899 |
173.7 |
-0.7 |
0.433 |
2 |
5 |
0 |
0.000 |
10 |
10 |
|
B |
12 |
4 |
9711 |
◊ |
A |
-x-1/2,-y+1,z-1/2 |
2_464 |
18 |
7 |
9899 |
129.3 |
-0.7 |
0.526 |
2 |
0 |
0 |
0.000 |
11 |
11 |
|
A |
8 |
5 |
9899 |
x |
A |
-x-1/2,-y,z-1/2 |
2_454 |
8 |
4 |
9899 |
56.0 |
-0.2 |
0.517 |
0 |
1 |
0 |
0.000 |
12 |
12 |
|
[CA]A:304 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
9899 |
42.2 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.079 |
13 |
|
[CA]B:304 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
9711 |
42.0 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.079 |
Average: |
42.1 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.079 |
13 |
14 |
|
[CA]B:303 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
9711 |
36.3 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.069 |
15 |
|
[CA]A:303 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
9899 |
36.2 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.069 |
Average: |
36.2 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.069 |
14 |
16 |
|
[ZN]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
9899 |
35.3 |
-23.9 |
0.000 |
0 |
0 |
0 |
0.220 |
17 |
|
[ZN]B:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
9711 |
34.5 |
-23.7 |
0.000 |
0 |
0 |
0 |
0.220 |
Average: |
34.9 |
-23.8 |
0.000 |
0 |
0 |
0 |
0.220 |
15 |
18 |
|
[ZN]A:302 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
9899 |
32.7 |
-24.6 |
0.000 |
0 |
0 |
0 |
0.225 |
19 |
|
[ZN]B:302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
4 |
9711 |
32.4 |
-24.1 |
0.000 |
0 |
0 |
0 |
0.225 |
Average: |
32.5 |
-24.3 |
0.000 |
0 |
0 |
0 |
0.225 |
16 |
20 |
|
[HCH]B:305 |
4 |
1 |
399 |
cf |
[ZN]B:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.2 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.108 |
21 |
|
[HCH]A:305 |
5 |
1 |
388 |
cf |
[ZN]A:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.9 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.108 |
Average: |
30.1 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.108 |
17 |
22 |
|
[HCH]A:305 |
4 |
1 |
388 |
cf |
[ZN]A:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.8 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.108 |
23 |
|
[HCH]B:305 |
4 |
1 |
399 |
cf |
[ZN]B:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.5 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.108 |
Average: |
29.6 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.108 |
18 |
24 |
|
[CA]B:303 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
9899 |
28.6 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.044 |
25 |
|
[CA]A:303 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
9711 |
28.6 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.044 |
Average: |
28.6 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.044 |
19 |
26 |
|
[CA]A:304 |
1 |
1 |
85 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
2 |
9899 |
14.9 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.000 |
20 |
27 |
|
B |
1 |
1 |
9711 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
2 |
9899 |
10.8 |
0.3 |
0.698 |
0 |
0 |
0 |
0.000 |
21 |
28 |
|
[ZN]B:302 |
1 |
1 |
98 |
f |
[ZN]B:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.0 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.030 |
22 |
29 |
|
[ZN]A:302 |
1 |
1 |
98 |
f |
[ZN]A:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.8 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.029 |
23 |
30 |
|
A |
1 |
1 |
9899 |
◊ |
[HCH]B:305 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
399 |
6.2 |
-0.2 |
0.423 |
0 |
0 |
0 |
0.000 |
|