## |
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 |
245 |
60 |
15492 |
◊ |
A |
x,y,z |
1_555 |
267 |
67 |
14639 |
2554.3 |
-37.2 |
0.307 |
21 |
13 |
0 |
0.300 |
2 |
|
B |
246 |
65 |
14686 |
◊ |
A |
x,y,z |
1_555 |
242 |
66 |
14639 |
2531.9 |
-35.9 |
0.291 |
19 |
9 |
0 |
0.300 |
3 |
|
D |
247 |
64 |
14619 |
◊ |
C |
x,y,z |
1_555 |
249 |
68 |
14731 |
2506.1 |
-37.6 |
0.251 |
20 |
11 |
0 |
0.300 |
4 |
|
E |
246 |
66 |
15492 |
◊ |
C |
x,y,z |
1_555 |
245 |
66 |
14731 |
2458.5 |
-35.4 |
0.327 |
17 |
8 |
0 |
0.300 |
5 |
|
D |
237 |
68 |
14619 |
◊ |
B |
x,y,z |
1_555 |
236 |
65 |
14686 |
2456.3 |
-29.8 |
0.489 |
19 |
10 |
0 |
0.300 |
Average: |
2501.4 |
-35.2 |
0.333 |
19 |
10 |
0 |
0.300 |
2 |
6 |
|
E |
41 |
11 |
15492 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
51 |
17 |
14639 |
424.4 |
-4.0 |
0.675 |
8 |
0 |
0 |
0.037 |
3 |
7 |
|
C |
43 |
12 |
14731 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
38 |
7 |
14686 |
378.4 |
-3.1 |
0.681 |
3 |
0 |
0 |
0.025 |
4 |
8 |
|
E |
52 |
16 |
15492 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
39 |
10 |
14686 |
369.8 |
-1.5 |
0.851 |
3 |
2 |
0 |
0.000 |
5 |
9 |
|
D |
39 |
10 |
14619 |
◊ |
E |
-x-1/2,-y,z-1/2 |
2_454 |
38 |
11 |
15492 |
316.2 |
-3.1 |
0.656 |
1 |
3 |
0 |
0.000 |
6 |
10 |
|
D |
22 |
9 |
14619 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
19 |
7 |
14639 |
196.0 |
-1.1 |
0.564 |
3 |
1 |
0 |
0.014 |
7 |
11 |
|
C |
16 |
5 |
14731 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
13 |
3 |
14639 |
108.9 |
-0.1 |
0.770 |
0 |
1 |
0 |
0.000 |
8 |
12 |
|
C |
10 |
2 |
14731 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
11 |
5 |
14639 |
85.4 |
-0.9 |
0.560 |
0 |
0 |
0 |
0.000 |
9 |
13 |
|
D |
13 |
3 |
14619 |
◊ |
C |
-x-1/2,-y,z-1/2 |
2_454 |
8 |
3 |
14731 |
71.9 |
-0.1 |
0.511 |
0 |
1 |
0 |
0.000 |
10 |
14 |
|
D |
7 |
4 |
14619 |
x |
D |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
2 |
14619 |
60.3 |
1.4 |
0.898 |
1 |
2 |
0 |
0.000 |
11 |
15 |
|
[ZN]E:301 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
14 |
5 |
15492 |
57.9 |
-36.5 |
0.000 |
0 |
0 |
0 |
0.413 |
16 |
|
[ZN]D:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
14619 |
56.1 |
-38.4 |
0.000 |
0 |
0 |
0 |
0.413 |
17 |
|
[ZN]A:303 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
14639 |
55.9 |
-32.8 |
0.000 |
0 |
0 |
0 |
0.413 |
18 |
|
[ZN]B:303 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
14686 |
53.2 |
-36.9 |
0.000 |
0 |
0 |
0 |
0.413 |
19 |
|
[ZN]C:303 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
14731 |
52.4 |
-37.9 |
0.000 |
0 |
0 |
0 |
0.413 |
Average: |
55.1 |
-36.5 |
0.000 |
0 |
0 |
0 |
0.413 |
12 |
20 |
|
[ZN]A:304 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
14639 |
50.2 |
-31.2 |
0.000 |
0 |
0 |
0 |
0.177 |
13 |
21 |
|
[ZN]B:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
14686 |
48.3 |
-25.8 |
0.000 |
0 |
0 |
0 |
0.143 |
14 |
22 |
|
[ZN]A:302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
14686 |
46.9 |
-22.9 |
0.000 |
0 |
0 |
0 |
0.254 |
23 |
|
[ZN]B:302 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
14619 |
46.5 |
-22.5 |
0.000 |
0 |
0 |
0 |
0.254 |
24 |
|
[ZN]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
14639 |
46.3 |
-22.3 |
0.000 |
0 |
0 |
0 |
0.254 |
25 |
|
[ZN]C:301 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
14731 |
46.0 |
-22.5 |
0.000 |
0 |
0 |
0 |
0.254 |
26 |
|
[ZN]C:302 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
9 |
5 |
15492 |
43.2 |
-21.4 |
0.000 |
0 |
0 |
0 |
0.254 |
Average: |
45.8 |
-22.3 |
0.000 |
0 |
0 |
0 |
0.254 |
15 |
27 |
|
[ZN]E:302 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
9 |
3 |
15492 |
43.1 |
-23.9 |
0.000 |
0 |
0 |
0 |
0.117 |
16 |
28 |
|
[ZN]A:301 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
6 |
2 |
15492 |
37.4 |
-17.2 |
0.000 |
0 |
0 |
0 |
0.113 |
29 |
|
[ZN]B:302 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
14686 |
37.3 |
-16.8 |
0.000 |
0 |
0 |
0 |
0.113 |
30 |
|
[ZN]C:301 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
14619 |
37.3 |
-16.6 |
0.000 |
0 |
0 |
0 |
0.113 |
31 |
|
[ZN]C:302 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
14731 |
37.1 |
-18.2 |
0.000 |
0 |
0 |
0 |
0.113 |
32 |
|
[ZN]A:302 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
14639 |
36.5 |
-16.6 |
0.000 |
0 |
0 |
0 |
0.113 |
Average: |
37.1 |
-17.1 |
0.000 |
0 |
0 |
0 |
0.113 |
17 |
33 |
|
[ZN]D:303 |
1 |
1 |
98 |
f |
C |
-x-1/2,-y,z-1/2 |
2_454 |
6 |
1 |
14731 |
31.4 |
-14.6 |
0.000 |
0 |
0 |
0 |
0.089 |
34 |
|
[ZN]D:302 |
1 |
1 |
98 |
cf |
A |
-x-1/2,-y,z-1/2 |
2_454 |
6 |
1 |
14639 |
28.7 |
-15.8 |
0.000 |
0 |
0 |
0 |
0.089 |
Average: |
30.0 |
-15.2 |
0.000 |
0 |
0 |
0 |
0.089 |
18 |
35 |
|
[ZN]D:303 |
1 |
1 |
98 |
◊ |
D |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
2 |
14619 |
31.3 |
-13.2 |
0.000 |
0 |
0 |
0 |
0.034 |
36 |
|
[ZN]D:302 |
1 |
1 |
98 |
◊ |
E |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
2 |
15492 |
27.3 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.034 |
Average: |
29.3 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.034 |
19 |
37 |
|
C |
3 |
2 |
14731 |
◊ |
[ZN]B:301 |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
98 |
30.9 |
-14.4 |
0.000 |
0 |
0 |
0 |
0.080 |
20 |
38 |
|
[ZN]D:303 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
14619 |
27.5 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.008 |
21 |
39 |
|
[ZN]D:302 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
14619 |
27.0 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.062 |
22 |
40 |
|
[ZN]E:302 |
1 |
1 |
98 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
8 |
3 |
14639 |
18.9 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.039 |
23 |
41 |
|
D |
2 |
2 |
14619 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
14639 |
18.7 |
-0.6 |
0.290 |
0 |
0 |
0 |
0.003 |
42 |
|
C |
3 |
2 |
14731 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
14639 |
17.8 |
-0.6 |
0.347 |
0 |
0 |
0 |
0.003 |
43 |
|
E |
2 |
2 |
15492 |
◊ |
D |
x,y,z |
1_555 |
2 |
2 |
14619 |
13.9 |
-0.4 |
0.357 |
0 |
0 |
0 |
0.003 |
44 |
|
C |
2 |
2 |
14731 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
14686 |
11.9 |
-0.4 |
0.380 |
0 |
0 |
0 |
0.003 |
45 |
|
E |
2 |
2 |
15492 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
14686 |
10.7 |
-0.3 |
0.405 |
0 |
0 |
0 |
0.003 |
Average: |
14.6 |
-0.5 |
0.356 |
0 |
0 |
0 |
0.003 |
24 |
46 |
|
[ZN]E:302 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
14731 |
18.4 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.010 |
25 |
47 |
|
E |
2 |
1 |
15492 |
◊ |
[ZN]A:304 |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
98 |
12.2 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.024 |
26 |
48 |
|
D |
1 |
1 |
14619 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
14686 |
4.9 |
-0.2 |
0.365 |
0 |
0 |
0 |
0.000 |
27 |
49 |
|
[ZN]C:303 |
1 |
1 |
98 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
2 |
2 |
14686 |
3.6 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.008 |
|