## |
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 |
100 |
27 |
7269 |
◊ |
A |
x,y,z |
1_555 |
99 |
27 |
7562 |
916.3 |
-11.4 |
0.288 |
16 |
0 |
0 |
0.521 |
2 |
2 |
|
B |
55 |
14 |
7269 |
◊ |
A |
-y,x+1,z+1/4 |
3_565 |
56 |
11 |
7562 |
503.8 |
-2.0 |
0.635 |
4 |
2 |
0 |
0.000 |
3 |
3 |
|
B |
50 |
14 |
7269 |
◊ |
A |
-y,-x,-z+1/4 |
8_555 |
49 |
15 |
7562 |
428.7 |
-9.2 |
0.130 |
8 |
0 |
0 |
0.428 |
4 |
4 |
|
B |
22 |
7 |
7269 |
◊ |
B |
-x,y,-z |
5_555 |
22 |
7 |
7269 |
203.4 |
0.5 |
0.767 |
2 |
0 |
0 |
0.000 |
5 |
5 |
|
[DMS]A:202 |
4 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
21 |
8 |
7562 |
137.5 |
3.0 |
0.506 |
1 |
0 |
0 |
0.000 |
6 |
|
[DMS]B:203 |
4 |
1 |
214 |
◊ |
B |
x,y,z |
1_555 |
22 |
8 |
7269 |
127.2 |
3.3 |
0.552 |
1 |
0 |
0 |
0.000 |
Average: |
132.4 |
3.2 |
0.529 |
1 |
0 |
0 |
0.000 |
6 |
7 |
|
[EDO]B:202 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
7269 |
113.4 |
4.0 |
0.536 |
2 |
0 |
0 |
0.000 |
7 |
8 |
|
B |
11 |
5 |
7269 |
◊ |
A |
-x,y,-z |
5_555 |
18 |
7 |
7562 |
108.5 |
0.6 |
0.760 |
1 |
0 |
0 |
0.000 |
8 |
9 |
|
B |
15 |
5 |
7269 |
◊ |
B |
x,-y+1,-z+1/2 |
6_565 |
15 |
5 |
7269 |
102.0 |
-1.8 |
0.402 |
0 |
0 |
0 |
0.000 |
9 |
10 |
|
A |
9 |
5 |
7562 |
◊ |
A |
-x,y,-z |
5_555 |
9 |
5 |
7562 |
70.8 |
0.2 |
0.678 |
0 |
0 |
0 |
0.000 |
10 |
11 |
|
[CL]B:201 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
7269 |
67.4 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.646 |
12 |
|
[CL]A:201 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
7562 |
66.5 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.646 |
Average: |
66.9 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.646 |
11 |
13 |
|
A |
6 |
4 |
7562 |
x |
A |
-y,x,z+1/4 |
3_555 |
6 |
1 |
7562 |
63.3 |
0.6 |
0.702 |
1 |
2 |
0 |
0.000 |
12 |
14 |
|
A |
8 |
4 |
7562 |
◊ |
A |
-y,-x,-z+1/4 |
8_555 |
8 |
4 |
7562 |
34.9 |
-0.7 |
0.492 |
0 |
0 |
0 |
0.015 |
15 |
|
B |
3 |
2 |
7269 |
◊ |
B |
-y,-x,-z+1/4 |
8_555 |
3 |
2 |
7269 |
25.3 |
-0.8 |
0.267 |
0 |
0 |
0 |
0.015 |
Average: |
30.1 |
-0.7 |
0.379 |
0 |
0 |
0 |
0.015 |
13 |
16 |
|
[EDO]B:202 |
2 |
1 |
184 |
f |
[CL]B:201 |
x,y,z |
1_555 |
1 |
1 |
125 |
14.1 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.040 |
14 |
17 |
|
B |
2 |
1 |
7269 |
f |
[DMS]A:202 |
-y,x+1,z+1/4 |
3_565 |
1 |
1 |
216 |
8.4 |
0.3 |
0.454 |
0 |
0 |
0 |
0.000 |
|