## |
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 |
101 |
27 |
12255 |
◊ |
A |
x-y,x,z+1/3 |
6_555 |
101 |
27 |
12111 |
918.8 |
-6.1 |
0.539 |
8 |
0 |
0 |
0.131 |
2 |
2 |
|
A |
70 |
18 |
12111 |
◊ |
B |
-y-1,x-y,z-1/3 |
2_454 |
72 |
16 |
12255 |
682.1 |
-2.2 |
0.652 |
5 |
0 |
0 |
0.122 |
3 |
3 |
|
B |
50 |
17 |
12255 |
◊ |
A |
x,y,z |
1_555 |
51 |
18 |
12111 |
543.5 |
-4.6 |
0.388 |
0 |
0 |
0 |
0.000 |
4 |
4 |
|
[V74]A:306 |
37 |
1 |
755 |
◊ |
A |
x,y,z |
1_555 |
62 |
17 |
12111 |
411.5 |
-7.2 |
0.826 |
2 |
0 |
0 |
0.328 |
5 |
|
[V74]B:305 |
37 |
1 |
755 |
◊ |
B |
x,y,z |
1_555 |
61 |
17 |
12255 |
408.1 |
-6.5 |
0.845 |
3 |
0 |
0 |
0.328 |
Average: |
409.8 |
-6.9 |
0.836 |
3 |
0 |
0 |
0.328 |
5 |
6 |
|
B |
24 |
10 |
12255 |
◊ |
B |
-x-1,-y-1,z |
4_445 |
24 |
10 |
12255 |
277.8 |
0.0 |
0.729 |
2 |
0 |
0 |
0.023 |
7 |
|
A |
24 |
10 |
12111 |
◊ |
A |
-x-1,-y,z |
4_455 |
24 |
10 |
12111 |
269.3 |
-0.2 |
0.682 |
2 |
0 |
0 |
0.023 |
Average: |
273.5 |
-0.1 |
0.706 |
2 |
0 |
0 |
0.023 |
6 |
8 |
|
A |
29 |
8 |
12111 |
◊ |
B |
x,y,z-1 |
1_554 |
32 |
6 |
12255 |
277.2 |
-2.1 |
0.499 |
2 |
0 |
0 |
0.000 |
7 |
9 |
|
[ACT]B:303 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
12255 |
102.2 |
-0.1 |
0.679 |
1 |
0 |
0 |
0.023 |
8 |
10 |
|
[ACT]A:301 |
4 |
1 |
180 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
12111 |
97.8 |
-0.9 |
0.510 |
3 |
0 |
0 |
0.090 |
9 |
11 |
|
[ACT]A:303 |
4 |
1 |
181 |
◊ |
A |
x,y,z |
1_555 |
16 |
8 |
12111 |
97.5 |
0.2 |
0.711 |
1 |
0 |
0 |
0.003 |
10 |
12 |
|
[ACT]B:301 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
12255 |
92.0 |
-1.0 |
0.522 |
3 |
0 |
0 |
0.095 |
11 |
13 |
|
B |
6 |
2 |
12255 |
◊ |
A |
-y,x-y,z+2/3 |
2_555 |
8 |
3 |
12111 |
80.4 |
1.2 |
0.785 |
1 |
0 |
0 |
0.000 |
12 |
14 |
|
[ACT]A:304 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
12111 |
74.4 |
-0.6 |
0.597 |
0 |
0 |
0 |
0.024 |
13 |
15 |
|
B |
14 |
6 |
12255 |
◊ |
[ACT]A:304 |
x-y,x,z+1/3 |
6_555 |
4 |
1 |
187 |
70.8 |
0.3 |
0.698 |
0 |
0 |
0 |
0.000 |
14 |
16 |
|
[ACT]A:302 |
4 |
1 |
184 |
f |
A |
-x-1,-y,z |
4_455 |
9 |
4 |
12111 |
69.7 |
-0.4 |
0.683 |
1 |
0 |
0 |
0.036 |
15 |
17 |
|
[ACT]B:302 |
4 |
1 |
182 |
f |
B |
-x-1,-y-1,z |
4_445 |
7 |
3 |
12255 |
67.5 |
-0.4 |
0.658 |
1 |
0 |
0 |
0.033 |
16 |
18 |
|
[CL]A:305 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
12111 |
54.5 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.375 |
19 |
|
[CL]B:304 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
12255 |
53.8 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.375 |
Average: |
54.1 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.375 |
17 |
20 |
|
[ACT]B:302 |
4 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
12255 |
50.9 |
0.4 |
0.815 |
2 |
0 |
0 |
0.019 |
18 |
21 |
|
[ACT]A:302 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
12111 |
47.3 |
0.6 |
0.833 |
2 |
0 |
0 |
0.011 |
19 |
22 |
|
[V74]A:306 |
4 |
1 |
755 |
cf |
[V74]A:306 |
-x-1,-y,z |
4_455 |
4 |
1 |
755 |
46.8 |
-4.3 |
0.249 |
0 |
0 |
0 |
0.100 |
23 |
|
[V74]B:305 |
4 |
1 |
755 |
cf |
[V74]B:305 |
-x-1,-y-1,z |
4_445 |
4 |
1 |
755 |
46.2 |
-4.4 |
0.236 |
0 |
0 |
0 |
0.100 |
Average: |
46.5 |
-4.4 |
0.243 |
0 |
0 |
0 |
0.100 |
20 |
24 |
|
A |
9 |
3 |
12111 |
◊ |
[CL]B:304 |
-y-1,x-y,z-1/3 |
2_454 |
1 |
1 |
125 |
41.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.270 |
25 |
|
[CL]A:305 |
1 |
1 |
125 |
◊ |
B |
-y-1,x-y,z-1/3 |
2_454 |
10 |
3 |
12255 |
40.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.270 |
Average: |
40.9 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.270 |
21 |
26 |
|
B |
2 |
1 |
12255 |
f |
[ACT]A:303 |
x-y,x,z+1/3 |
6_555 |
4 |
1 |
181 |
33.7 |
-1.0 |
0.255 |
0 |
0 |
0 |
0.043 |
22 |
27 |
|
[ACT]A:301 |
1 |
1 |
180 |
◊ |
A |
-x-1,-y,z |
4_455 |
7 |
3 |
12111 |
32.6 |
-0.9 |
0.326 |
0 |
0 |
0 |
0.038 |
23 |
28 |
|
[ACT]B:303 |
4 |
1 |
183 |
◊ |
A |
x-y,x,z+1/3 |
6_555 |
2 |
1 |
12111 |
30.9 |
-0.5 |
0.307 |
0 |
0 |
0 |
0.007 |
24 |
29 |
|
[V74]B:305 |
5 |
1 |
755 |
◊ |
[ACT]B:302 |
x,y,z |
1_555 |
3 |
1 |
182 |
28.1 |
-0.1 |
0.777 |
1 |
0 |
0 |
0.022 |
25 |
30 |
|
[V74]A:306 |
6 |
1 |
755 |
◊ |
[ACT]A:302 |
x,y,z |
1_555 |
4 |
1 |
184 |
27.5 |
-0.1 |
0.865 |
1 |
0 |
0 |
0.020 |
26 |
31 |
|
[V74]A:306 |
4 |
1 |
755 |
◊ |
A |
-x-1,-y,z |
4_455 |
5 |
3 |
12111 |
26.4 |
-0.1 |
0.793 |
0 |
0 |
0 |
0.004 |
32 |
|
[V74]B:305 |
4 |
1 |
755 |
◊ |
B |
-x-1,-y-1,z |
4_445 |
4 |
3 |
12255 |
24.4 |
0.3 |
0.853 |
0 |
0 |
0 |
0.004 |
Average: |
25.4 |
0.1 |
0.823 |
0 |
0 |
0 |
0.004 |
27 |
33 |
|
[ACT]B:301 |
1 |
1 |
183 |
◊ |
B |
-x-1,-y-1,z |
4_445 |
2 |
2 |
12255 |
21.3 |
-0.1 |
0.477 |
0 |
0 |
0 |
0.005 |
28 |
34 |
|
[ACT]B:301 |
1 |
1 |
183 |
◊ |
[ACT]A:304 |
x-y,x,z+1/3 |
6_555 |
3 |
1 |
187 |
18.5 |
-0.1 |
0.606 |
0 |
0 |
0 |
0.002 |
29 |
35 |
|
[CL]B:304 |
1 |
1 |
125 |
◊ |
B |
-x-1,-y-1,z |
4_445 |
1 |
1 |
12255 |
13.0 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.045 |
36 |
|
[CL]A:305 |
1 |
1 |
125 |
◊ |
A |
-x-1,-y,z |
4_455 |
1 |
1 |
12111 |
12.7 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.045 |
Average: |
12.9 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.045 |
30 |
37 |
|
[V74]A:306 |
1 |
1 |
755 |
◊ |
[ACT]A:302 |
-x-1,-y,z |
4_455 |
2 |
1 |
184 |
11.6 |
-0.6 |
0.285 |
0 |
0 |
0 |
0.025 |
31 |
38 |
|
[ACT]A:302 |
1 |
1 |
184 |
◊ |
[ACT]A:301 |
x,y,z |
1_555 |
2 |
1 |
180 |
10.3 |
0.1 |
0.559 |
0 |
0 |
0 |
0.000 |
32 |
39 |
|
[V74]B:305 |
1 |
1 |
755 |
◊ |
[ACT]B:302 |
-x-1,-y-1,z |
4_445 |
1 |
1 |
182 |
9.8 |
-0.5 |
0.349 |
0 |
0 |
0 |
0.019 |
33 |
40 |
|
[ACT]A:304 |
1 |
1 |
187 |
◊ |
B |
-y-1,x-y,z-1/3 |
2_454 |
2 |
1 |
12255 |
9.0 |
0.0 |
0.477 |
0 |
0 |
0 |
0.000 |
34 |
41 |
|
[ACT]B:302 |
1 |
1 |
182 |
◊ |
[ACT]B:301 |
x,y,z |
1_555 |
3 |
1 |
183 |
8.6 |
0.2 |
0.586 |
0 |
0 |
0 |
0.000 |
35 |
42 |
|
[ACT]B:301 |
1 |
1 |
183 |
◊ |
A |
x-y,x,z+1/3 |
6_555 |
2 |
2 |
12111 |
4.5 |
-0.0 |
0.593 |
0 |
0 |
0 |
0.000 |
36 |
43 |
|
[V74]B:305 |
1 |
1 |
755 |
◊ |
[ACT]B:303 |
x,y,z |
1_555 |
1 |
1 |
183 |
1.8 |
-0.1 |
0.647 |
0 |
0 |
0 |
0.002 |
37 |
44 |
|
B |
1 |
1 |
12255 |
◊ |
[ACT]A:301 |
x-y,x,z+1/3 |
6_555 |
1 |
1 |
180 |
0.2 |
0.0 |
0.568 |
0 |
0 |
0 |
0.000 |
|