| ## |
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 |
103 |
28 |
10365 |
◊ |
B |
-x+1,-y,z |
2_655 |
102 |
28 |
10365 |
1038.5 |
-15.2 |
0.124 |
8 |
2 |
0 |
0.228 |
2 |
|
A |
106 |
28 |
10842 |
◊ |
A |
-x+1,-y,z |
2_655 |
106 |
28 |
10842 |
1028.9 |
-15.2 |
0.130 |
8 |
2 |
0 |
0.228 |
| Average: |
1033.7 |
-15.2 |
0.127 |
8 |
2 |
0 |
0.228 |
| 2 |
3 |
|
B |
63 |
18 |
10365 |
◊ |
A |
x,y,z-1 |
1_554 |
68 |
18 |
10842 |
720.5 |
-7.6 |
0.307 |
7 |
6 |
0 |
0.092 |
| 3 |
4 |
|
B |
74 |
20 |
10365 |
◊ |
A |
x-1/2,-y+1/2,-z-1 |
4_454 |
75 |
21 |
10842 |
676.3 |
-3.6 |
0.657 |
13 |
8 |
0 |
0.010 |
| 4 |
5 |
|
B |
42 |
14 |
10365 |
◊ |
A |
x,y,z |
1_555 |
48 |
14 |
10842 |
412.4 |
-7.8 |
0.141 |
3 |
0 |
0 |
0.075 |
| 5 |
6 |
|
[GOL]A:306 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
10842 |
130.7 |
-1.2 |
0.489 |
1 |
0 |
0 |
0.023 |
| 6 |
7 |
|
[GOL]B:304 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
10365 |
116.4 |
0.4 |
0.697 |
6 |
0 |
0 |
0.055 |
| 7 |
8 |
|
[SO4]A:303 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
10842 |
100.2 |
-15.6 |
0.873 |
6 |
0 |
0 |
0.256 |
| 8 |
9 |
|
[SO4]A:305 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
10842 |
95.2 |
-14.6 |
0.784 |
3 |
0 |
0 |
0.223 |
| 9 |
10 |
|
[SO4]B:303 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
10365 |
94.0 |
-14.3 |
0.805 |
5 |
0 |
0 |
0.395 |
| 10 |
11 |
|
B |
9 |
4 |
10365 |
◊ |
A |
-x+1,-y,z-1 |
2_654 |
8 |
4 |
10842 |
82.8 |
-1.8 |
0.255 |
0 |
0 |
0 |
0.014 |
| 11 |
12 |
|
[SO4]A:304 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
10842 |
82.5 |
-11.4 |
0.693 |
2 |
0 |
0 |
0.173 |
| 12 |
13 |
|
[MN3]A:302 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
10842 |
72.2 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.091 |
14 |
|
[MN3]B:302 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
10365 |
68.2 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.091 |
| Average: |
70.2 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.091 |
| 13 |
15 |
|
[MN3]A:301 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
10842 |
54.5 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.120 |
16 |
|
[MN3]B:301 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
10365 |
53.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.120 |
| Average: |
54.2 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.120 |
| 14 |
17 |
|
[GOL]A:306 |
4 |
1 |
217 |
◊ |
A |
-x+1,-y,z |
2_655 |
5 |
2 |
10842 |
43.8 |
0.9 |
0.792 |
2 |
0 |
0 |
0.000 |
| 15 |
18 |
|
[MN3]B:302 |
1 |
1 |
123 |
f |
[MN3]B:301 |
x,y,z |
1_555 |
1 |
1 |
123 |
21.7 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.052 |
| 16 |
19 |
|
[MN3]A:302 |
1 |
1 |
123 |
f |
[MN3]A:301 |
x,y,z |
1_555 |
1 |
1 |
123 |
21.2 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.030 |
| 17 |
20 |
|
[SO4]B:303 |
2 |
1 |
184 |
f |
[MN3]B:301 |
x,y,z |
1_555 |
1 |
1 |
123 |
13.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.059 |
| 18 |
21 |
|
[SO4]A:305 |
3 |
1 |
185 |
f |
[MN3]A:301 |
x,y,z |
1_555 |
1 |
1 |
123 |
13.3 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.031 |
| 19 |
22 |
|
B |
1 |
1 |
10365 |
x |
B |
x-1/2,-y+1/2,-z-1 |
4_454 |
1 |
1 |
10365 |
2.8 |
0.0 |
0.563 |
0 |
0 |
0 |
0.000 |
|