| ## |
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 |
|
A |
51 |
17 |
12730 |
◊ |
B |
x-1,y,z |
1_455 |
47 |
15 |
12684 |
504.9 |
-7.6 |
0.139 |
4 |
2 |
0 |
0.000 |
2 |
|
B |
46 |
17 |
12684 |
◊ |
A |
x,y,z |
1_555 |
38 |
11 |
12730 |
437.5 |
-6.4 |
0.142 |
3 |
1 |
0 |
0.000 |
| Average: |
471.2 |
-7.0 |
0.141 |
4 |
2 |
0 |
0.000 |
| 2 |
3 |
|
[76J]A:1805 |
30 |
1 |
686 |
f |
A |
x,y,z |
1_555 |
73 |
25 |
12730 |
459.6 |
5.0 |
0.597 |
8 |
0 |
0 |
0.000 |
4 |
|
[76J]B:1805 |
29 |
1 |
687 |
f |
B |
x,y,z |
1_555 |
70 |
24 |
12684 |
457.6 |
4.5 |
0.588 |
9 |
0 |
0 |
0.000 |
| Average: |
458.6 |
4.8 |
0.592 |
9 |
0 |
0 |
0.000 |
| 3 |
5 |
|
A |
35 |
11 |
12730 |
x |
A |
-x+1,y-1/2,-z+2 |
2_647 |
34 |
13 |
12730 |
327.1 |
-1.8 |
0.508 |
4 |
0 |
0 |
0.000 |
| 4 |
6 |
|
A |
26 |
10 |
12730 |
◊ |
B |
x-1,y,z+1 |
1_456 |
26 |
9 |
12684 |
228.6 |
-2.1 |
0.430 |
1 |
0 |
0 |
0.000 |
7 |
|
B |
25 |
9 |
12684 |
◊ |
A |
x,y,z-1 |
1_554 |
24 |
9 |
12730 |
218.0 |
-2.3 |
0.395 |
1 |
0 |
0 |
0.000 |
| Average: |
223.3 |
-2.2 |
0.413 |
1 |
0 |
0 |
0.000 |
| 5 |
8 |
|
B |
13 |
3 |
12684 |
x |
B |
x-1,y,z |
1_455 |
22 |
7 |
12684 |
148.0 |
-0.2 |
0.573 |
2 |
0 |
0 |
0.000 |
9 |
|
A |
12 |
6 |
12730 |
x |
A |
x-1,y,z |
1_455 |
12 |
6 |
12730 |
109.4 |
-1.2 |
0.363 |
1 |
0 |
0 |
0.000 |
| Average: |
128.7 |
-0.7 |
0.468 |
2 |
0 |
0 |
0.000 |
| 6 |
10 |
|
A |
13 |
6 |
12730 |
◊ |
B |
-x+1,y-1/2,-z+2 |
2_647 |
20 |
7 |
12684 |
141.5 |
0.4 |
0.652 |
1 |
0 |
0 |
0.000 |
| 7 |
11 |
|
[SCN]A:1804 |
3 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
12730 |
96.1 |
-3.1 |
0.494 |
2 |
0 |
0 |
0.014 |
| 8 |
12 |
|
[SCN]B:1804 |
3 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
12684 |
92.1 |
-3.1 |
0.478 |
2 |
0 |
0 |
0.012 |
| 9 |
13 |
|
B |
5 |
4 |
12684 |
x |
B |
-x+2,y-1/2,-z+1 |
2_746 |
7 |
4 |
12684 |
49.7 |
-0.9 |
0.301 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
A |
3 |
1 |
12730 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
5 |
2 |
12684 |
31.8 |
-0.8 |
0.274 |
0 |
0 |
0 |
0.000 |
| 11 |
15 |
|
[SCN]B:1804 |
1 |
1 |
185 |
f |
[ZN]B:1802 |
x,y,z |
1_555 |
1 |
1 |
98 |
20.0 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.030 |
| 12 |
16 |
|
[SCN]A:1804 |
1 |
1 |
183 |
f |
[ZN]A:1802 |
x,y,z |
1_555 |
1 |
1 |
98 |
17.1 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.029 |
| 13 |
17 |
|
[ZN]B:1802 |
1 |
1 |
98 |
f |
[ZN]B:1801 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.0 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.037 |
| 14 |
18 |
|
[ZN]A:1803 |
1 |
1 |
98 |
f |
[ZN]A:1802 |
x,y,z |
1_555 |
1 |
1 |
98 |
14.1 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.041 |
| 15 |
19 |
|
[SCN]B:1804 |
1 |
1 |
185 |
f |
[ZN]B:1801 |
x,y,z |
1_555 |
1 |
1 |
98 |
12.7 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.019 |
| 16 |
20 |
|
[SCN]A:1804 |
1 |
1 |
183 |
f |
[ZN]A:1803 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.0 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.015 |
| 17 |
21 |
|
[76J]A:1805 |
1 |
1 |
686 |
f |
[ZN]A:1801 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.1 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.006 |
22 |
|
[76J]B:1805 |
1 |
1 |
687 |
f |
[ZN]B:1803 |
x,y,z |
1_555 |
1 |
1 |
98 |
3.6 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.006 |
| Average: |
3.9 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.006 |
|