| ## |
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 |
|
[PM4]A:301 |
27 |
1 |
721 |
cf |
A |
x,y,z |
1_555 |
65 |
20 |
4947 |
439.0 |
-2.3 |
0.404 |
4 |
0 |
0 |
0.028 |
| 2 |
2 |
|
[PM4]B:302 |
26 |
1 |
721 |
cf |
B |
x,y,z |
1_555 |
57 |
19 |
4787 |
410.1 |
-1.5 |
0.385 |
2 |
0 |
0 |
0.011 |
| 3 |
3 |
|
A |
37 |
11 |
4947 |
x |
A |
x,y,z-1 |
1_554 |
32 |
11 |
4947 |
304.1 |
-1.2 |
0.502 |
2 |
1 |
0 |
0.000 |
4 |
|
B |
37 |
11 |
4787 |
x |
B |
x,y,z-1 |
1_554 |
35 |
11 |
4787 |
286.9 |
-1.3 |
0.454 |
2 |
1 |
0 |
0.000 |
| Average: |
295.5 |
-1.2 |
0.478 |
2 |
1 |
0 |
0.000 |
| 4 |
5 |
|
B |
34 |
9 |
4787 |
◊ |
A |
x,y,z |
1_555 |
33 |
10 |
4947 |
299.5 |
5.0 |
0.936 |
8 |
4 |
0 |
0.000 |
| 5 |
6 |
|
B |
29 |
9 |
4787 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
28 |
8 |
4947 |
231.7 |
-0.9 |
0.529 |
2 |
0 |
0 |
0.008 |
| 6 |
7 |
|
B |
23 |
8 |
4787 |
◊ |
A |
-x+1,-y+1,z-1 |
2_664 |
21 |
7 |
4947 |
187.2 |
-1.4 |
0.389 |
2 |
2 |
0 |
0.010 |
| 7 |
8 |
|
A |
19 |
8 |
4947 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
23 |
8 |
4787 |
171.9 |
1.1 |
0.691 |
2 |
1 |
0 |
0.000 |
| 8 |
9 |
|
A |
21 |
9 |
4947 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
18 |
6 |
4787 |
149.4 |
2.0 |
0.838 |
4 |
2 |
0 |
0.000 |
| 9 |
10 |
|
A |
12 |
5 |
4947 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
12 |
5 |
4947 |
134.8 |
0.5 |
0.704 |
0 |
0 |
0 |
0.000 |
| 10 |
11 |
|
B |
18 |
5 |
4787 |
◊ |
A |
x,y,z-1 |
1_554 |
16 |
5 |
4947 |
108.5 |
0.6 |
0.724 |
0 |
0 |
0 |
0.000 |
| 11 |
12 |
|
A |
8 |
3 |
4947 |
◊ |
B |
x-1,y,z+1 |
1_456 |
11 |
5 |
4787 |
93.4 |
2.1 |
0.810 |
1 |
0 |
0 |
0.000 |
| 12 |
13 |
|
A |
7 |
3 |
4947 |
◊ |
B |
x-1,y,z |
1_455 |
10 |
4 |
4787 |
78.4 |
0.2 |
0.624 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[ZN]B:409 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
4787 |
54.3 |
-27.5 |
0.000 |
0 |
0 |
0 |
0.250 |
15 |
|
[ZN]A:405 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
4947 |
51.7 |
-27.1 |
0.000 |
0 |
0 |
0 |
0.250 |
| Average: |
53.0 |
-27.3 |
0.000 |
0 |
0 |
0 |
0.250 |
| 14 |
16 |
|
B |
8 |
2 |
4787 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
8 |
2 |
4787 |
50.2 |
0.9 |
0.781 |
0 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[ZN]A:408 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
8 |
4 |
4947 |
46.6 |
-22.7 |
0.000 |
0 |
0 |
0 |
0.157 |
| 16 |
18 |
|
[ZN]A:403 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
4947 |
43.2 |
-21.8 |
0.000 |
0 |
0 |
0 |
0.151 |
| 17 |
19 |
|
[ZN]A:404 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
7 |
3 |
4947 |
39.6 |
-18.6 |
0.000 |
0 |
0 |
0 |
0.178 |
20 |
|
[ZN]A:402 |
1 |
1 |
98 |
f |
B |
x-1/2,-y+1/2,-z |
4_455 |
7 |
3 |
4787 |
39.3 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.178 |
| Average: |
39.4 |
-19.4 |
0.000 |
0 |
0 |
0 |
0.178 |
| 18 |
21 |
|
[ZN]A:406 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
4947 |
38.9 |
-16.9 |
0.000 |
0 |
0 |
0 |
0.153 |
22 |
|
B |
6 |
3 |
4787 |
f |
[ZN]B:407 |
x,y,z-1 |
1_554 |
1 |
1 |
98 |
33.4 |
-16.4 |
0.000 |
0 |
0 |
0 |
0.153 |
| Average: |
36.1 |
-16.6 |
0.000 |
0 |
0 |
0 |
0.153 |
| 19 |
23 |
|
[ZN]A:404 |
1 |
1 |
98 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
10 |
4 |
4787 |
38.7 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.000 |
24 |
|
[ZN]A:402 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
4947 |
36.8 |
-18.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
37.7 |
-19.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 20 |
25 |
|
[ZN]B:410 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
4787 |
36.9 |
-17.5 |
0.000 |
0 |
0 |
0 |
0.080 |
| 21 |
26 |
|
A |
6 |
2 |
4947 |
f |
[ZN]B:411 |
x-1,y,z+1 |
1_456 |
1 |
1 |
98 |
36.1 |
-19.6 |
0.000 |
0 |
0 |
0 |
0.135 |
| 22 |
27 |
|
[ZN]A:401 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
4787 |
30.6 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.054 |
| 23 |
28 |
|
[ZN]B:407 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
4787 |
29.7 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
5 |
3 |
4947 |
◊ |
[ZN]A:406 |
x,y,z-1 |
1_554 |
1 |
1 |
98 |
26.9 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
28.3 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 24 |
30 |
|
[ZN]B:410 |
1 |
1 |
98 |
◊ |
A |
x,y,z-1 |
1_554 |
5 |
2 |
4947 |
28.6 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.050 |
| 25 |
31 |
|
[ZN]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
4947 |
28.6 |
-14.1 |
0.000 |
0 |
0 |
0 |
0.097 |
| 26 |
32 |
|
[ZN]B:411 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
4787 |
27.7 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.005 |
| 27 |
33 |
|
[PM4]B:302 |
2 |
1 |
721 |
◊ |
B |
x,y,z-1 |
1_554 |
6 |
2 |
4787 |
27.2 |
-1.4 |
0.306 |
0 |
0 |
0 |
0.000 |
| 28 |
34 |
|
B |
3 |
1 |
4787 |
◊ |
[ZN]A:406 |
x,y,z-1 |
1_554 |
1 |
1 |
98 |
26.6 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.080 |
35 |
|
[ZN]B:407 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
4947 |
25.8 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.080 |
| Average: |
26.2 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.080 |
| 29 |
36 |
|
A |
5 |
2 |
4947 |
◊ |
[ZN]A:405 |
x,y,z-1 |
1_554 |
1 |
1 |
98 |
26.1 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.000 |
37 |
|
[ZN]B:409 |
1 |
1 |
98 |
◊ |
B |
x,y,z-1 |
1_554 |
5 |
2 |
4787 |
25.6 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
25.9 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 30 |
38 |
|
A |
6 |
3 |
4947 |
◊ |
[PM4]A:301 |
x,y,z-1 |
1_554 |
2 |
1 |
721 |
25.3 |
-1.3 |
0.342 |
0 |
0 |
0 |
0.000 |
| 31 |
39 |
|
[ZN]A:401 |
1 |
1 |
98 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
5 |
1 |
4787 |
24.3 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.046 |
| 32 |
40 |
|
A |
6 |
3 |
4947 |
◊ |
[ZN]B:411 |
x-1,y,z |
1_455 |
1 |
1 |
98 |
22.8 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 33 |
41 |
|
[PM4]A:301 |
2 |
1 |
721 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
4787 |
20.2 |
0.2 |
0.445 |
0 |
0 |
0 |
0.000 |
| 34 |
42 |
|
[ZN]A:403 |
1 |
1 |
98 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
2 |
4787 |
18.8 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.034 |
| 35 |
43 |
|
B |
1 |
1 |
4787 |
◊ |
B |
-x+2,-y+1,z |
2_765 |
1 |
1 |
4787 |
12.1 |
0.9 |
0.938 |
0 |
0 |
0 |
0.000 |
| 36 |
44 |
|
[ZN]B:410 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
4947 |
10.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.020 |
| 37 |
45 |
|
A |
2 |
1 |
4947 |
◊ |
[PM4]B:302 |
x-1,y,z+1 |
1_456 |
2 |
1 |
721 |
7.5 |
0.1 |
0.625 |
0 |
0 |
0 |
0.000 |
| 38 |
46 |
|
[ZN]B:410 |
1 |
1 |
98 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
2 |
1 |
4787 |
5.5 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.009 |
| 39 |
47 |
|
[ZN]B:410 |
1 |
1 |
98 |
◊ |
[ZN]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.9 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.017 |
| 40 |
48 |
|
[ZN]B:410 |
1 |
1 |
98 |
◊ |
[ZN]A:406 |
x,y,z-1 |
1_554 |
1 |
1 |
98 |
1.0 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.003 |
| 41 |
49 |
|
[ZN]A:401 |
1 |
1 |
98 |
◊ |
A |
x,y,z-1 |
1_554 |
2 |
1 |
4947 |
0.9 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
|