| ## |
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 |
321 |
81 |
22586 |
◊ |
A |
x,y,z |
1_555 |
332 |
82 |
22484 |
3166.7 |
-41.8 |
0.015 |
39 |
14 |
0 |
0.659 |
| 2 |
2 |
|
B |
134 |
40 |
22586 |
◊ |
A |
-x,y,-z |
2_555 |
136 |
37 |
22484 |
1166.0 |
-14.5 |
0.163 |
11 |
0 |
0 |
0.340 |
| 3 |
3 |
|
B |
66 |
24 |
22586 |
◊ |
B |
-x,y,-z-1 |
2_554 |
67 |
24 |
22586 |
709.5 |
-5.7 |
0.357 |
4 |
4 |
0 |
0.000 |
| 4 |
4 |
|
D |
55 |
10 |
1282 |
◊ |
B |
x,y,z |
1_555 |
95 |
33 |
22586 |
679.0 |
-3.1 |
0.751 |
11 |
0 |
1 |
0.468 |
5 |
|
C |
55 |
10 |
1259 |
◊ |
A |
x,y,z |
1_555 |
90 |
30 |
22484 |
677.5 |
-4.1 |
0.667 |
12 |
0 |
1 |
0.468 |
| Average: |
678.3 |
-3.6 |
0.709 |
12 |
0 |
1 |
0.468 |
| 5 |
6 |
|
A |
55 |
15 |
22484 |
◊ |
B |
-x+1/2,y-1/2,-z |
4_545 |
55 |
14 |
22586 |
469.1 |
-0.4 |
0.732 |
3 |
4 |
0 |
0.000 |
| 6 |
7 |
|
B |
53 |
17 |
22586 |
◊ |
A |
x,y,z-1 |
1_554 |
47 |
20 |
22484 |
407.4 |
-0.8 |
0.632 |
1 |
1 |
0 |
0.000 |
| 7 |
8 |
|
[OGA]A:902 |
10 |
1 |
283 |
f |
A |
x,y,z |
1_555 |
32 |
16 |
22484 |
172.1 |
-0.1 |
0.385 |
4 |
0 |
0 |
0.076 |
9 |
|
[OGA]B:902 |
10 |
1 |
283 |
f |
B |
x,y,z |
1_555 |
34 |
16 |
22586 |
170.2 |
-0.5 |
0.315 |
4 |
0 |
0 |
0.076 |
| Average: |
171.2 |
-0.3 |
0.350 |
4 |
0 |
0 |
0.076 |
| 8 |
10 |
|
[EDO]B:904 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
24 |
7 |
22586 |
105.1 |
4.3 |
0.735 |
5 |
0 |
0 |
0.000 |
| 9 |
11 |
|
A |
6 |
3 |
22484 |
◊ |
A |
-x,y,-z+1 |
2_556 |
6 |
3 |
22484 |
74.0 |
0.3 |
0.728 |
2 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[SO4]B:903 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
22586 |
72.8 |
-10.2 |
0.766 |
2 |
0 |
0 |
0.367 |
| 11 |
13 |
|
[SO4]A:903 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
22484 |
57.2 |
-6.5 |
0.877 |
0 |
0 |
0 |
0.227 |
| 12 |
14 |
|
[MN]A:901 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
22484 |
49.9 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.131 |
15 |
|
[MN]B:901 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
22586 |
49.6 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.131 |
| Average: |
49.8 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.131 |
| 13 |
16 |
|
[SO4]B:903 |
4 |
1 |
185 |
◊ |
A |
-x,y,-z |
2_555 |
7 |
3 |
22484 |
44.5 |
-6.0 |
0.610 |
0 |
0 |
0 |
0.106 |
| 14 |
17 |
|
[OGA]B:902 |
4 |
1 |
283 |
f |
[MN]B:901 |
x,y,z |
1_555 |
1 |
1 |
123 |
33.1 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.085 |
18 |
|
[OGA]A:902 |
4 |
1 |
283 |
f |
[MN]A:901 |
x,y,z |
1_555 |
1 |
1 |
123 |
32.5 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.085 |
| Average: |
32.8 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.085 |
| 15 |
19 |
|
[MN]A:901 |
1 |
1 |
123 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
1259 |
23.6 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.048 |
20 |
|
[MN]B:901 |
1 |
1 |
123 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
1282 |
22.7 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.048 |
| Average: |
23.1 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.048 |
| 16 |
21 |
|
[OGA]A:902 |
3 |
1 |
283 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
1259 |
23.2 |
0.7 |
0.584 |
0 |
0 |
0 |
0.000 |
22 |
|
[OGA]B:902 |
4 |
1 |
283 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
1282 |
20.4 |
0.0 |
0.481 |
0 |
0 |
0 |
0.000 |
| Average: |
21.8 |
0.3 |
0.533 |
0 |
0 |
0 |
0.000 |
| 17 |
23 |
|
A |
1 |
1 |
22484 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
2 |
1 |
22484 |
5.3 |
-0.0 |
0.601 |
0 |
0 |
0 |
0.000 |
| 18 |
24 |
|
B |
1 |
1 |
22586 |
x |
B |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
22586 |
2.6 |
-0.1 |
0.409 |
0 |
0 |
0 |
0.000 |
| 19 |
25 |
|
A |
1 |
1 |
22484 |
◊ |
[SO4]A:903 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
186 |
2.4 |
-0.3 |
0.857 |
0 |
0 |
0 |
0.000 |
|