| ## |
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 |
110 |
29 |
6923 |
◊ |
C |
-x,y,-z+1 |
2_556 |
109 |
29 |
6923 |
1087.7 |
-9.7 |
0.415 |
10 |
0 |
0 |
0.379 |
2 |
|
B |
105 |
30 |
6792 |
◊ |
A |
x,y,z |
1_555 |
110 |
29 |
7048 |
1036.6 |
-13.8 |
0.180 |
8 |
0 |
0 |
0.379 |
| Average: |
1062.2 |
-11.7 |
0.298 |
9 |
0 |
0 |
0.379 |
| 2 |
3 |
|
C |
37 |
7 |
6923 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
48 |
11 |
6792 |
390.2 |
-2.2 |
0.502 |
3 |
2 |
0 |
0.115 |
| 3 |
4 |
|
A |
38 |
10 |
7048 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
38 |
10 |
6792 |
372.0 |
1.1 |
0.807 |
3 |
2 |
0 |
0.000 |
| 4 |
5 |
|
C |
44 |
13 |
6923 |
◊ |
A |
x,y,z |
1_555 |
42 |
12 |
7048 |
356.5 |
-2.4 |
0.565 |
1 |
0 |
0 |
0.000 |
| 5 |
6 |
|
B |
28 |
9 |
6792 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
28 |
9 |
7048 |
337.3 |
-3.0 |
0.382 |
2 |
2 |
0 |
0.000 |
| 6 |
7 |
|
[3PF]B:1000 |
12 |
1 |
321 |
f |
B |
x,y,z |
1_555 |
29 |
12 |
6792 |
219.6 |
-4.8 |
0.468 |
2 |
0 |
0 |
0.569 |
8 |
|
[3PF]A:1000 |
12 |
1 |
323 |
f |
A |
x,y,z |
1_555 |
30 |
12 |
7048 |
219.4 |
-4.7 |
0.470 |
2 |
0 |
0 |
0.569 |
9 |
|
[3PF]C:1000 |
12 |
1 |
321 |
f |
C |
x,y,z |
1_555 |
29 |
12 |
6923 |
210.4 |
-4.2 |
0.546 |
2 |
0 |
0 |
0.569 |
| Average: |
216.4 |
-4.6 |
0.495 |
2 |
0 |
0 |
0.569 |
| 7 |
10 |
|
C |
19 |
8 |
6923 |
◊ |
A |
-x,y,-z |
2_555 |
16 |
3 |
7048 |
136.8 |
-2.5 |
0.331 |
0 |
0 |
0 |
0.000 |
| 8 |
11 |
|
[EDO]A:1188 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
21 |
7 |
7048 |
118.1 |
4.1 |
0.707 |
4 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[SO4]C:1184 |
5 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
13 |
4 |
6923 |
86.4 |
-12.9 |
0.760 |
4 |
0 |
0 |
0.547 |
| 10 |
13 |
|
[SO4]A:1191 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
7048 |
84.4 |
-12.3 |
0.851 |
4 |
0 |
0 |
0.308 |
| 11 |
14 |
|
[EDO]A:1187 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
7048 |
84.3 |
1.7 |
0.337 |
0 |
0 |
0 |
0.000 |
| 12 |
15 |
|
[EDO]B:1186 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
6792 |
84.2 |
2.0 |
0.339 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[EDO]B:1187 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
6792 |
79.0 |
2.8 |
0.329 |
2 |
0 |
0 |
0.000 |
| 14 |
17 |
|
[SO4]A:1190 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
7048 |
71.4 |
-9.2 |
0.859 |
2 |
0 |
0 |
0.220 |
| 15 |
18 |
|
[SO4]C:1184 |
4 |
1 |
184 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
9 |
4 |
6792 |
63.2 |
-8.2 |
0.879 |
2 |
0 |
0 |
0.269 |
| 16 |
19 |
|
C |
5 |
2 |
6923 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
6792 |
53.7 |
-0.4 |
0.534 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
B |
3 |
1 |
6792 |
f |
[EDO]A:1187 |
-x+1/2,y-1/2,-z |
4_545 |
4 |
1 |
184 |
42.2 |
1.2 |
0.949 |
2 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[EDO]B:1186 |
4 |
1 |
182 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
7048 |
40.4 |
1.3 |
0.946 |
1 |
0 |
0 |
0.000 |
| 19 |
22 |
|
[EDO]B:1186 |
4 |
1 |
182 |
f |
[3PF]B:1000 |
x,y,z |
1_555 |
6 |
1 |
321 |
35.6 |
0.5 |
0.958 |
0 |
0 |
0 |
0.000 |
| 20 |
23 |
|
[EDO]A:1187 |
3 |
1 |
184 |
◊ |
[3PF]A:1000 |
x,y,z |
1_555 |
6 |
1 |
323 |
35.1 |
0.6 |
0.959 |
0 |
0 |
0 |
0.000 |
| 21 |
24 |
|
[3PF]C:1000 |
2 |
1 |
321 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
7048 |
12.1 |
-0.4 |
0.661 |
0 |
0 |
0 |
0.000 |
|