| ## |
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 |
49 |
13 |
5719 |
◊ |
A |
x,y,z |
1_555 |
44 |
15 |
5897 |
463.3 |
-0.4 |
0.652 |
4 |
2 |
0 |
0.000 |
| 2 |
2 |
|
A |
48 |
13 |
5897 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
48 |
12 |
5719 |
405.8 |
-1.4 |
0.565 |
5 |
0 |
0 |
0.000 |
| 3 |
3 |
|
B |
42 |
13 |
5719 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
39 |
11 |
5897 |
359.1 |
-2.0 |
0.468 |
4 |
0 |
0 |
0.000 |
| 4 |
4 |
|
A |
37 |
9 |
5897 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
41 |
11 |
5719 |
329.1 |
-6.2 |
0.136 |
1 |
0 |
0 |
0.000 |
| 5 |
5 |
|
D |
22 |
2 |
559 |
◊ |
B |
x,y,z |
1_555 |
39 |
10 |
5719 |
273.4 |
-6.2 |
0.558 |
7 |
0 |
0 |
1.000 |
| 6 |
6 |
|
C |
22 |
2 |
557 |
◊ |
A |
x,y,z |
1_555 |
38 |
10 |
5897 |
252.3 |
-6.0 |
0.531 |
8 |
0 |
0 |
1.000 |
| 7 |
7 |
|
[DIY]C:103 |
9 |
1 |
329 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
14 |
5 |
5719 |
100.4 |
2.6 |
0.021 |
0 |
0 |
0 |
0.000 |
8 |
|
A |
18 |
4 |
5897 |
◊ |
[DIY]D:103 |
-x+3/2,-y,z-1/2 |
2_654 |
9 |
1 |
320 |
95.2 |
2.4 |
0.016 |
0 |
0 |
0 |
0.000 |
| Average: |
97.8 |
2.5 |
0.018 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[DIY]C:103 |
6 |
1 |
329 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
5897 |
85.7 |
2.9 |
0.184 |
0 |
0 |
0 |
0.000 |
10 |
|
[DIY]D:103 |
6 |
1 |
320 |
◊ |
B |
x,y,z |
1_555 |
10 |
6 |
5719 |
82.9 |
2.8 |
0.125 |
0 |
0 |
0 |
0.000 |
| Average: |
84.3 |
2.9 |
0.155 |
0 |
0 |
0 |
0.000 |
| 9 |
11 |
|
[DIY]C:103 |
6 |
1 |
329 |
cf |
C |
x,y,z |
1_555 |
7 |
2 |
557 |
70.0 |
1.1 |
0.026 |
0 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[DIY]D:103 |
7 |
1 |
320 |
cf |
D |
x,y,z |
1_555 |
8 |
2 |
559 |
69.4 |
1.0 |
0.007 |
0 |
0 |
0 |
0.000 |
| 11 |
13 |
|
A |
11 |
3 |
5897 |
◊ |
D |
-x+3/2,-y,z-1/2 |
2_654 |
7 |
2 |
559 |
67.5 |
0.0 |
0.727 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
C |
6 |
2 |
557 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
11 |
3 |
5719 |
67.0 |
-0.0 |
0.716 |
0 |
0 |
0 |
0.000 |
| 13 |
15 |
|
[ACE]D:100 |
3 |
1 |
171 |
cf |
D |
x,y,z |
1_555 |
11 |
2 |
559 |
58.5 |
-0.5 |
0.897 |
0 |
0 |
0 |
0.081 |
| 14 |
16 |
|
[ACE]D:100 |
3 |
1 |
171 |
◊ |
B |
x,y,z |
1_555 |
7 |
2 |
5719 |
54.8 |
0.7 |
0.932 |
1 |
0 |
0 |
0.006 |
17 |
|
[ACE]C:100 |
3 |
1 |
170 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
5897 |
43.4 |
0.4 |
0.883 |
1 |
0 |
0 |
0.006 |
| Average: |
49.1 |
0.6 |
0.907 |
1 |
0 |
0 |
0.006 |
| 15 |
18 |
|
[ACE]C:100 |
3 |
1 |
170 |
cf |
C |
x,y,z |
1_555 |
11 |
2 |
557 |
51.1 |
-0.4 |
0.837 |
0 |
0 |
0 |
0.066 |
| 16 |
19 |
|
C |
6 |
1 |
557 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
5719 |
47.7 |
-1.1 |
0.621 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
[ACE]C:100 |
1 |
1 |
170 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
5719 |
46.0 |
-1.1 |
0.561 |
0 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[DIY]C:103 |
4 |
1 |
329 |
◊ |
[DIY]D:103 |
-x+3/2,-y,z-1/2 |
2_654 |
6 |
1 |
320 |
39.7 |
2.6 |
0.002 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
B |
2 |
2 |
5719 |
x |
B |
-x+3/2,-y,z-1/2 |
2_654 |
4 |
2 |
5719 |
35.5 |
0.8 |
0.745 |
0 |
0 |
0 |
0.000 |
| 20 |
23 |
|
B |
1 |
1 |
5719 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
5719 |
20.5 |
-0.7 |
0.103 |
0 |
0 |
0 |
0.000 |
| 21 |
24 |
|
[ACE]C:100 |
2 |
1 |
170 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
2 |
1 |
5719 |
12.9 |
0.3 |
0.907 |
0 |
0 |
0 |
0.000 |
25 |
|
A |
2 |
1 |
5897 |
◊ |
[ACE]D:100 |
-x+3/2,-y,z-1/2 |
2_654 |
2 |
1 |
171 |
12.0 |
0.2 |
0.897 |
0 |
0 |
0 |
0.000 |
| Average: |
12.5 |
0.3 |
0.902 |
0 |
0 |
0 |
0.000 |
|