| ## |
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 |
25 |
11897 |
◊ |
A |
x,y,z |
1_555 |
94 |
24 |
11785 |
926.9 |
-11.2 |
0.229 |
10 |
12 |
0 |
0.437 |
| 2 |
2 |
|
B |
45 |
13 |
11897 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
45 |
12 |
11785 |
456.2 |
-2.6 |
0.563 |
5 |
4 |
0 |
0.174 |
| 3 |
3 |
|
D |
32 |
5 |
821 |
◊ |
B |
x,y,z |
1_555 |
43 |
20 |
11897 |
418.7 |
-8.9 |
0.711 |
11 |
0 |
0 |
0.617 |
4 |
|
C |
28 |
4 |
736 |
◊ |
A |
x,y,z |
1_555 |
41 |
19 |
11785 |
386.9 |
-6.9 |
0.732 |
12 |
2 |
0 |
0.617 |
| Average: |
402.8 |
-7.9 |
0.722 |
12 |
1 |
0 |
0.617 |
| 4 |
5 |
|
B |
28 |
9 |
11897 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
35 |
14 |
11785 |
313.9 |
-0.4 |
0.698 |
6 |
0 |
0 |
0.000 |
| 5 |
6 |
|
B |
24 |
9 |
11897 |
◊ |
A |
x,y-1,z |
1_545 |
20 |
7 |
11785 |
209.8 |
0.2 |
0.729 |
4 |
0 |
0 |
0.000 |
| 6 |
7 |
|
B |
19 |
7 |
11897 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
18 |
10 |
11897 |
143.8 |
-0.4 |
0.592 |
1 |
1 |
0 |
0.000 |
| 7 |
8 |
|
[LPD]C:201 |
7 |
1 |
262 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
11785 |
110.2 |
-0.7 |
0.630 |
0 |
0 |
0 |
0.035 |
9 |
|
[LPD]D:201 |
7 |
1 |
262 |
◊ |
B |
x,y,z |
1_555 |
14 |
7 |
11897 |
99.6 |
-0.5 |
0.658 |
0 |
0 |
0 |
0.035 |
| Average: |
104.9 |
-0.6 |
0.644 |
0 |
0 |
0 |
0.035 |
| 8 |
10 |
|
[EDO]A:302 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
19 |
6 |
11785 |
91.4 |
2.0 |
0.280 |
5 |
0 |
0 |
0.022 |
| 9 |
11 |
|
[LPD]D:201 |
8 |
1 |
262 |
cf |
D |
x,y,z |
1_555 |
14 |
2 |
821 |
89.9 |
-1.1 |
0.854 |
0 |
0 |
0 |
0.100 |
12 |
|
[LPD]C:201 |
8 |
1 |
262 |
cf |
C |
x,y,z |
1_555 |
14 |
2 |
736 |
89.6 |
-1.1 |
0.844 |
0 |
0 |
0 |
0.100 |
| Average: |
89.8 |
-1.1 |
0.849 |
0 |
0 |
0 |
0.100 |
| 10 |
13 |
|
[EDO]A:301 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
11785 |
78.8 |
2.9 |
0.326 |
1 |
0 |
0 |
0.000 |
| 11 |
14 |
|
B |
10 |
3 |
11897 |
◊ |
[EDO]A:301 |
-x+2,y-1/2,-z+1/2 |
3_745 |
3 |
1 |
183 |
78.6 |
2.8 |
0.637 |
0 |
0 |
0 |
0.000 |
| 12 |
15 |
|
[UNX]B:301 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
14 |
4 |
11897 |
67.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.158 |
| 13 |
16 |
|
[UNX]B:304 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
11897 |
66.3 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.173 |
| 14 |
17 |
|
[UNX]A:304 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
11785 |
60.3 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.447 |
| 15 |
18 |
|
[UNX]B:305 |
1 |
1 |
129 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
11897 |
58.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.131 |
| 16 |
19 |
|
[UNX]B:302 |
1 |
1 |
129 |
◊ |
B |
x,y,z |
1_555 |
11 |
6 |
11897 |
56.8 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.233 |
20 |
|
[UNX]B:302 |
1 |
1 |
129 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
11 |
6 |
11785 |
55.5 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.233 |
| Average: |
56.2 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.233 |
| 17 |
21 |
|
[UNX]B:303 |
1 |
1 |
129 |
f |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
11 |
5 |
11785 |
52.9 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.321 |
| 18 |
22 |
|
A |
5 |
4 |
11785 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
7 |
3 |
11897 |
46.9 |
-0.5 |
0.485 |
0 |
0 |
0 |
0.000 |
| 19 |
23 |
|
[UNX]A:303 |
1 |
1 |
129 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
11785 |
46.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.260 |
| 20 |
24 |
|
B |
8 |
3 |
11897 |
◊ |
[UNX]A:304 |
x,y-1,z |
1_545 |
1 |
1 |
129 |
39.3 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 21 |
25 |
|
[UNX]B:305 |
1 |
1 |
129 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
11785 |
39.0 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.054 |
| 22 |
26 |
|
[UNX]D:202 |
1 |
1 |
129 |
f |
D |
x,y,z |
1_555 |
4 |
1 |
821 |
37.8 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.063 |
| 23 |
27 |
|
[UNX]D:202 |
1 |
1 |
129 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
11897 |
25.4 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.032 |
| 24 |
28 |
|
B |
1 |
1 |
11897 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
6 |
3 |
11785 |
25.3 |
-0.7 |
0.189 |
0 |
0 |
0 |
0.000 |
| 25 |
29 |
|
[UNX]B:303 |
1 |
1 |
129 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
11897 |
24.5 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.029 |
| 26 |
30 |
|
[UNX]B:304 |
1 |
1 |
129 |
◊ |
D |
x,y,z |
1_555 |
3 |
3 |
821 |
22.9 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.054 |
| 27 |
31 |
|
[UNX]B:303 |
1 |
1 |
129 |
◊ |
[UNX]A:303 |
-x+2,y-1/2,-z+1/2 |
3_745 |
1 |
1 |
129 |
19.7 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.184 |
|