## |
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 |
|
C |
96 |
31 |
11041 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
95 |
31 |
11146 |
906.5 |
3.5 |
0.761 |
7 |
17 |
0 |
0.000 |
2 |
2 |
|
B |
50 |
15 |
11049 |
◊ |
A |
x,y,z |
1_555 |
45 |
15 |
11146 |
393.5 |
2.4 |
0.736 |
4 |
2 |
0 |
0.000 |
3 |
3 |
|
C |
42 |
11 |
11041 |
◊ |
B |
x,y,z |
1_555 |
43 |
12 |
11049 |
340.7 |
2.7 |
0.762 |
5 |
4 |
0 |
0.000 |
4 |
4 |
|
[L43]D:301 |
20 |
1 |
453 |
f |
D |
x,y,z |
1_555 |
37 |
14 |
11068 |
293.3 |
3.8 |
0.380 |
3 |
0 |
0 |
0.000 |
5 |
|
[L43]C:301 |
20 |
1 |
451 |
f |
C |
x,y,z |
1_555 |
37 |
14 |
11041 |
291.9 |
3.8 |
0.388 |
3 |
0 |
0 |
0.000 |
Average: |
292.6 |
3.8 |
0.384 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
C |
26 |
10 |
11041 |
◊ |
A |
x,y,z |
1_555 |
24 |
8 |
11146 |
248.9 |
-2.2 |
0.271 |
2 |
1 |
0 |
0.000 |
6 |
7 |
|
D |
26 |
7 |
11068 |
◊ |
C |
x,y,z |
1_555 |
29 |
8 |
11041 |
244.6 |
-0.8 |
0.379 |
1 |
2 |
0 |
0.000 |
7 |
8 |
|
C |
17 |
5 |
11041 |
◊ |
D |
x-1,y,z |
1_455 |
17 |
7 |
11068 |
163.4 |
1.8 |
0.766 |
1 |
1 |
0 |
0.000 |
8 |
9 |
|
[EDO]C:303 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
23 |
10 |
11041 |
124.3 |
3.0 |
0.371 |
1 |
0 |
0 |
0.000 |
9 |
10 |
|
[EDO]A:302 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
11146 |
121.2 |
2.9 |
0.369 |
1 |
0 |
0 |
0.000 |
10 |
11 |
|
[EDO]A:301 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
20 |
7 |
11146 |
111.9 |
3.7 |
0.451 |
1 |
0 |
0 |
0.000 |
11 |
12 |
|
[EDO]D:303 |
4 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
19 |
6 |
11068 |
110.0 |
3.7 |
0.477 |
1 |
0 |
0 |
0.000 |
12 |
13 |
|
[EDO]C:305 |
4 |
1 |
184 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
22 |
8 |
11146 |
100.9 |
3.0 |
0.425 |
1 |
0 |
0 |
0.000 |
13 |
14 |
|
[EDO]B:301 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
11049 |
80.4 |
2.2 |
0.282 |
2 |
0 |
0 |
0.000 |
14 |
15 |
|
[EDO]C:304 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
11041 |
77.9 |
2.3 |
0.284 |
2 |
0 |
0 |
0.000 |
16 |
|
[EDO]D:304 |
4 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
11068 |
77.1 |
2.2 |
0.286 |
2 |
0 |
0 |
0.000 |
Average: |
77.5 |
2.3 |
0.285 |
2 |
0 |
0 |
0.000 |
15 |
17 |
|
[EDO]C:304 |
4 |
1 |
184 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
11 |
5 |
11146 |
75.7 |
1.7 |
0.230 |
0 |
0 |
0 |
0.000 |
16 |
18 |
|
[EDO]D:305 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
5 |
3 |
11068 |
65.5 |
1.5 |
0.835 |
0 |
0 |
0 |
0.000 |
17 |
19 |
|
[CL]D:302 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
7 |
3 |
11068 |
59.7 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.000 |
20 |
|
[CL]C:302 |
1 |
1 |
125 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
8 |
3 |
11146 |
50.7 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.000 |
21 |
|
[CL]C:302 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
11041 |
50.6 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
53.7 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
[EDO]C:305 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
5 |
3 |
11041 |
58.9 |
1.2 |
0.823 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
D |
1 |
1 |
11068 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
11049 |
12.0 |
-0.4 |
0.177 |
0 |
0 |
0 |
0.000 |
|