## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
53 |
14 |
8185 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
63 |
20 |
8760 |
571.2 |
-0.9 |
0.733 |
7 |
7 |
0 |
0.031 |
2 |
|
B |
48 |
11 |
8760 |
◊ |
A |
x,y,z-1 |
1_554 |
59 |
17 |
8185 |
453.2 |
-3.1 |
0.536 |
5 |
6 |
0 |
0.037 |
3 |
|
A |
41 |
11 |
8185 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
31 |
10 |
8760 |
287.7 |
-3.2 |
0.415 |
0 |
0 |
0 |
0.000 |
4 |
|
B |
30 |
8 |
8760 |
◊ |
A |
x,y,z |
1_555 |
29 |
10 |
8185 |
247.3 |
-2.2 |
0.479 |
2 |
2 |
0 |
0.000 |
5 |
|
[M5E]B:601 |
12 |
1 |
348 |
f |
B |
x,y,z |
1_555 |
44 |
15 |
8760 |
236.0 |
-4.2 |
0.436 |
3 |
0 |
0 |
0.034 |
6 |
|
[M5E]A:601 |
13 |
1 |
343 |
f |
A |
x,y,z |
1_555 |
34 |
11 |
8185 |
183.1 |
-2.3 |
0.624 |
3 |
0 |
0 |
0.022 |
7 |
|
A |
14 |
6 |
8185 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
20 |
7 |
8760 |
162.0 |
-0.4 |
0.594 |
1 |
0 |
0 |
0.000 |
8 |
|
B |
13 |
6 |
8760 |
x |
B |
x,y,z-1 |
1_554 |
16 |
8 |
8760 |
123.9 |
-0.3 |
0.621 |
3 |
0 |
0 |
0.000 |
9 |
|
[M5E]A:602 |
11 |
1 |
348 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
8185 |
112.4 |
-1.4 |
0.301 |
0 |
0 |
0 |
0.000 |
10 |
|
B |
13 |
3 |
8760 |
◊ |
[M5E]A:602 |
x,y,z-1 |
1_554 |
10 |
1 |
348 |
95.6 |
-1.7 |
0.452 |
0 |
0 |
0 |
0.000 |
11 |
|
[SO4]B:602 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
8760 |
94.5 |
-15.1 |
0.760 |
4 |
0 |
0 |
0.102 |
12 |
|
B |
9 |
3 |
8760 |
x |
B |
x-1,y,z |
1_455 |
8 |
3 |
8760 |
92.4 |
1.1 |
0.810 |
1 |
0 |
0 |
0.000 |
13 |
|
[SO4]A:603 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
9 |
8185 |
91.5 |
-14.8 |
0.828 |
5 |
0 |
0 |
0.103 |
14 |
|
[SO4]A:604 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
4 |
8185 |
88.6 |
-11.5 |
0.859 |
5 |
0 |
0 |
0.083 |
15 |
|
[M5E]A:602 |
10 |
1 |
348 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
8760 |
87.8 |
-1.7 |
0.573 |
0 |
0 |
0 |
0.010 |
16 |
|
[SO4]B:605 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
8760 |
86.5 |
-12.2 |
0.719 |
2 |
0 |
0 |
0.079 |
17 |
|
[SO4]A:606 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
8185 |
79.4 |
-11.6 |
0.765 |
2 |
0 |
0 |
0.075 |
18 |
|
[SO4]A:605 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
8185 |
78.9 |
-10.7 |
0.883 |
3 |
0 |
0 |
0.073 |
19 |
|
[SO4]B:603 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
15 |
4 |
8760 |
75.6 |
-11.0 |
0.834 |
2 |
0 |
0 |
0.072 |
20 |
|
[SO4]B:604 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
8760 |
75.0 |
-9.9 |
0.914 |
2 |
0 |
0 |
0.065 |
21 |
|
B |
10 |
3 |
8760 |
◊ |
[SO4]A:605 |
x,y,z-1 |
1_554 |
5 |
1 |
185 |
72.7 |
-8.2 |
0.881 |
2 |
0 |
0 |
0.055 |
22 |
|
[SO4]A:607 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
8185 |
71.1 |
-9.2 |
0.928 |
4 |
0 |
0 |
0.066 |
23 |
|
[SO4]A:604 |
5 |
1 |
185 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
10 |
3 |
8760 |
65.8 |
-8.5 |
0.874 |
2 |
0 |
0 |
0.057 |
24 |
|
[SO4]B:606 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
8760 |
64.3 |
-7.8 |
0.856 |
2 |
0 |
0 |
0.053 |
25 |
|
[SO4]B:604 |
4 |
1 |
186 |
◊ |
B |
x-1,y,z |
1_455 |
5 |
3 |
8760 |
53.4 |
-6.4 |
0.925 |
2 |
0 |
0 |
0.000 |
26 |
|
[SO4]A:603 |
5 |
1 |
184 |
f |
[M5E]A:601 |
x,y,z |
1_555 |
8 |
1 |
343 |
48.4 |
-6.1 |
0.856 |
0 |
0 |
0 |
0.037 |
27 |
|
[SO4]B:602 |
5 |
1 |
184 |
f |
[M5E]B:601 |
x,y,z |
1_555 |
7 |
1 |
348 |
47.9 |
-6.2 |
0.855 |
1 |
0 |
0 |
0.040 |
28 |
|
B |
5 |
3 |
8760 |
◊ |
[SO4]B:606 |
x-1,y,z |
1_455 |
3 |
1 |
185 |
34.0 |
-3.9 |
0.886 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
2 |
1 |
8185 |
◊ |
[SO4]B:605 |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
185 |
33.4 |
-4.4 |
0.366 |
0 |
0 |
0 |
0.000 |
30 |
|
A |
5 |
3 |
8185 |
x |
A |
x-1,y,z |
1_455 |
5 |
4 |
8185 |
17.4 |
-0.2 |
0.566 |
0 |
0 |
0 |
0.000 |
31 |
|
A |
2 |
2 |
8185 |
◊ |
[SO4]A:607 |
x,y,z-1 |
1_554 |
1 |
1 |
186 |
6.1 |
-0.6 |
0.788 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
2 |
1 |
8185 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
8760 |
5.7 |
-0.1 |
0.414 |
0 |
0 |
0 |
0.000 |
|