## |
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 |
105 |
27 |
12475 |
◊ |
A |
x,y,z |
1_555 |
114 |
28 |
12433 |
1062.3 |
-6.3 |
0.346 |
10 |
1 |
0 |
0.031 |
2 |
2 |
|
A |
60 |
21 |
12433 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
63 |
19 |
12475 |
531.8 |
1.2 |
0.747 |
6 |
0 |
0 |
0.004 |
3 |
3 |
|
B |
31 |
9 |
12475 |
x |
B |
x-1,y,z |
1_455 |
31 |
12 |
12475 |
264.9 |
-1.1 |
0.439 |
0 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
27 |
8 |
12433 |
x |
A |
-x+1,y-1/2,-z-1/2 |
3_644 |
22 |
6 |
12433 |
242.2 |
-2.1 |
0.340 |
1 |
1 |
0 |
0.000 |
5 |
5 |
|
B |
26 |
11 |
12475 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
28 |
11 |
12475 |
204.7 |
-0.6 |
0.549 |
1 |
0 |
0 |
0.000 |
6 |
6 |
|
B |
13 |
7 |
12475 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
19 |
7 |
12433 |
138.7 |
2.4 |
0.868 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
A |
14 |
6 |
12433 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
14 |
4 |
12475 |
127.5 |
-1.9 |
0.273 |
0 |
0 |
0 |
0.000 |
8 |
8 |
|
B |
10 |
3 |
12475 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
9 |
5 |
12433 |
67.4 |
-1.2 |
0.343 |
0 |
0 |
0 |
0.000 |
9 |
9 |
|
B |
11 |
3 |
12475 |
◊ |
A |
x-1,y,z |
1_455 |
8 |
4 |
12433 |
63.7 |
-0.3 |
0.471 |
0 |
0 |
0 |
0.000 |
10 |
10 |
|
A |
10 |
4 |
12433 |
x |
A |
x-1,y,z |
1_455 |
5 |
3 |
12433 |
57.2 |
0.8 |
0.745 |
1 |
0 |
0 |
0.000 |
11 |
11 |
|
[CU]A:501 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
12433 |
56.5 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.075 |
12 |
|
[CU]B:501 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
9 |
12475 |
55.9 |
-14.5 |
0.000 |
0 |
0 |
0 |
0.075 |
Average: |
56.2 |
-13.2 |
0.000 |
0 |
0 |
0 |
0.075 |
12 |
13 |
|
[ZN]B:506 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
12475 |
56.2 |
-28.9 |
0.000 |
0 |
0 |
0 |
0.181 |
14 |
|
[ZN]A:508 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
12433 |
50.4 |
-35.3 |
0.000 |
0 |
0 |
0 |
0.181 |
Average: |
53.3 |
-32.1 |
0.000 |
0 |
0 |
0 |
0.181 |
13 |
15 |
|
[CU]B:502 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
8 |
12475 |
55.5 |
-14.5 |
0.000 |
0 |
0 |
0 |
0.072 |
16 |
|
[CU]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
6 |
12433 |
52.9 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.072 |
Average: |
54.2 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.072 |
14 |
17 |
|
[ZN]B:505 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
9 |
8 |
12475 |
53.3 |
-30.6 |
0.000 |
0 |
0 |
0 |
0.086 |
15 |
18 |
|
[ZN]A:506 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
12433 |
50.0 |
-27.8 |
0.000 |
0 |
0 |
0 |
0.156 |
19 |
|
[ZN]B:504 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
12475 |
49.0 |
-27.3 |
0.000 |
0 |
0 |
0 |
0.156 |
Average: |
49.5 |
-27.5 |
0.000 |
0 |
0 |
0 |
0.156 |
16 |
20 |
|
[ZN]A:503 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
12433 |
46.8 |
-30.2 |
0.000 |
0 |
0 |
0 |
0.173 |
21 |
|
[ZN]B:503 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
8 |
3 |
12475 |
46.5 |
-30.9 |
0.000 |
0 |
0 |
0 |
0.173 |
Average: |
46.7 |
-30.5 |
0.000 |
0 |
0 |
0 |
0.173 |
17 |
22 |
|
[ZN]A:504 |
1 |
1 |
98 |
f |
B |
-x+1/2,-y,z-1/2 |
2_554 |
9 |
3 |
12475 |
44.5 |
-23.9 |
0.000 |
0 |
0 |
0 |
0.068 |
18 |
23 |
|
[ZN]A:505 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
12433 |
39.2 |
-18.5 |
0.000 |
0 |
0 |
0 |
0.052 |
19 |
24 |
|
[ZN]A:507 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
12433 |
34.9 |
-15.6 |
0.000 |
0 |
0 |
0 |
0.044 |
20 |
25 |
|
[ZN]A:504 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
12433 |
33.7 |
-14.9 |
0.000 |
0 |
0 |
0 |
0.041 |
21 |
26 |
|
[ZN]A:505 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
12475 |
29.8 |
-13.3 |
0.000 |
0 |
0 |
0 |
0.038 |
22 |
27 |
|
B |
3 |
1 |
12475 |
◊ |
[ZN]A:507 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
98 |
29.6 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.000 |
23 |
28 |
|
[CU]B:502 |
1 |
1 |
125 |
f |
[CU]B:501 |
x,y,z |
1_555 |
1 |
1 |
125 |
22.1 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.012 |
24 |
29 |
|
[CU]A:502 |
1 |
1 |
125 |
f |
[CU]A:501 |
x,y,z |
1_555 |
1 |
1 |
125 |
22.1 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.012 |
25 |
30 |
|
[ZN]A:503 |
1 |
1 |
98 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
7 |
2 |
12475 |
22.1 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.049 |
31 |
|
A |
8 |
3 |
12433 |
◊ |
[ZN]B:503 |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
98 |
20.1 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.049 |
Average: |
21.1 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.049 |
|