## |
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 |
|
F |
259 |
78 |
20959 |
x |
F |
z,x,y |
5_555 |
252 |
78 |
20959 |
2481.8 |
-18.2 |
0.338 |
23 |
4 |
0 |
0.196 |
2 |
|
F |
62 |
19 |
20959 |
x |
F |
z-1/4,y+1/4,-x+1/4 |
21_455 |
67 |
26 |
20959 |
572.7 |
-1.5 |
0.592 |
7 |
1 |
0 |
0.000 |
3 |
|
F |
33 |
10 |
20959 |
◊ |
F |
-y-1/4,-x-1/4,-z-1/4 |
14_444 |
33 |
10 |
20959 |
257.0 |
-1.8 |
0.655 |
4 |
4 |
0 |
0.018 |
4 |
|
[NHE]F:612 |
12 |
1 |
361 |
f |
F |
x,y,z |
1_555 |
27 |
8 |
20959 |
190.9 |
3.4 |
0.212 |
2 |
0 |
0 |
0.000 |
5 |
|
F |
22 |
10 |
20959 |
◊ |
F |
y-1/4,x+1/4,-z+1/4 |
13_455 |
22 |
10 |
20959 |
183.8 |
2.1 |
0.886 |
4 |
0 |
0 |
0.000 |
6 |
|
F |
17 |
6 |
20959 |
◊ |
F |
-z-1/4,-y-1/4,-x-1/4 |
24_444 |
17 |
6 |
20959 |
116.2 |
0.5 |
0.787 |
0 |
0 |
0 |
0.000 |
7 |
|
[TAR]F:613 |
10 |
1 |
270 |
f |
F |
x,y,z |
1_555 |
16 |
8 |
20959 |
114.9 |
0.5 |
0.560 |
3 |
0 |
0 |
0.007 |
8 |
|
F |
11 |
6 |
20959 |
◊ |
F |
-x+1/4,z-1/4,y+1/4 |
18_545 |
11 |
6 |
20959 |
113.4 |
-0.8 |
0.497 |
0 |
0 |
0 |
0.000 |
9 |
|
[SO4]F:604 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
12 |
5 |
20959 |
104.1 |
-15.5 |
0.632 |
3 |
0 |
0 |
0.149 |
10 |
|
F |
18 |
8 |
20959 |
f |
[SO4]F:608 |
z,x,y |
5_555 |
5 |
1 |
185 |
95.7 |
-13.4 |
0.748 |
2 |
0 |
0 |
0.125 |
11 |
|
[SO4]F:603 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
11 |
5 |
20959 |
90.6 |
-12.1 |
0.883 |
3 |
0 |
0 |
0.119 |
12 |
|
[SO4]F:602 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
18 |
8 |
20959 |
90.4 |
-11.8 |
0.862 |
3 |
0 |
0 |
0.116 |
13 |
|
[SO4]F:601 |
5 |
1 |
185 |
f |
F |
z,x,y |
5_555 |
13 |
5 |
20959 |
79.8 |
-10.2 |
0.897 |
5 |
0 |
0 |
0.109 |
14 |
|
[SO4]F:609 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
13 |
6 |
20959 |
73.6 |
-10.1 |
0.824 |
2 |
0 |
0 |
0.097 |
15 |
|
[SO4]F:610 |
4 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
12 |
6 |
20959 |
69.5 |
-8.7 |
0.900 |
1 |
0 |
0 |
0.080 |
16 |
|
[SO4]F:611 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
11 |
5 |
20959 |
62.2 |
-9.3 |
0.874 |
2 |
0 |
0 |
0.090 |
17 |
|
[SO4]F:608 |
4 |
1 |
185 |
◊ |
F |
x,y,z |
1_555 |
11 |
4 |
20959 |
61.9 |
-8.3 |
0.731 |
1 |
0 |
0 |
0.059 |
18 |
|
[SO4]F:611 |
5 |
1 |
185 |
◊ |
F |
-y-1/4,-x-1/4,-z-1/4 |
14_444 |
11 |
5 |
20959 |
61.9 |
-9.2 |
0.872 |
2 |
0 |
0 |
0.089 |
19 |
|
[SO4]F:605 |
5 |
1 |
185 |
◊ |
F |
x,y,z |
1_555 |
14 |
5 |
20959 |
58.7 |
-7.8 |
0.736 |
1 |
0 |
0 |
0.038 |
20 |
|
[SO4]F:610 |
5 |
1 |
185 |
◊ |
F |
z-1/4,y+1/4,-x+1/4 |
21_455 |
6 |
3 |
20959 |
57.5 |
-7.0 |
0.446 |
0 |
0 |
0 |
0.000 |
21 |
|
[SO4]F:601 |
5 |
1 |
185 |
◊ |
F |
x,y,z |
1_555 |
11 |
3 |
20959 |
54.6 |
-6.8 |
0.831 |
2 |
0 |
0 |
0.052 |
22 |
|
[SO4]F:607 |
5 |
1 |
185 |
◊ |
F |
x,y,z |
1_555 |
13 |
4 |
20959 |
50.9 |
-6.4 |
0.673 |
0 |
0 |
0 |
0.029 |
23 |
|
[SO4]F:605 |
3 |
1 |
185 |
f |
[SO4]F:606 |
z,x,y |
5_555 |
4 |
1 |
185 |
29.2 |
-6.6 |
0.995 |
0 |
0 |
0 |
0.030 |
24 |
|
[SO4]F:606 |
4 |
1 |
185 |
f |
[SO4]F:605 |
z,x,y |
5_555 |
3 |
1 |
185 |
29.0 |
-6.5 |
0.995 |
0 |
0 |
0 |
0.030 |
25 |
|
[SO4]F:606 |
4 |
1 |
185 |
f |
[SO4]F:605 |
x,y,z |
1_555 |
3 |
1 |
185 |
28.9 |
-6.6 |
0.995 |
0 |
0 |
0 |
0.030 |
26 |
|
[SO4]F:607 |
4 |
1 |
185 |
f |
[SO4]F:606 |
z,x,y |
5_555 |
3 |
1 |
185 |
23.6 |
-5.2 |
0.995 |
0 |
0 |
0 |
0.024 |
27 |
|
[SO4]F:607 |
4 |
1 |
185 |
f |
[SO4]F:606 |
x,y,z |
1_555 |
3 |
1 |
185 |
23.4 |
-5.2 |
0.995 |
0 |
0 |
0 |
0.024 |
28 |
|
[SO4]F:606 |
3 |
1 |
185 |
f |
[SO4]F:607 |
z,x,y |
5_555 |
4 |
1 |
185 |
23.2 |
-5.1 |
0.995 |
0 |
0 |
0 |
0.024 |
29 |
|
F |
3 |
1 |
20959 |
◊ |
[SO4]F:607 |
z,x,y |
5_555 |
3 |
1 |
185 |
21.9 |
-2.6 |
0.458 |
0 |
0 |
0 |
0.012 |
30 |
|
[SO4]F:607 |
3 |
1 |
185 |
f |
[SO4]F:605 |
x,y,z |
1_555 |
4 |
1 |
185 |
17.9 |
-4.0 |
0.995 |
0 |
0 |
0 |
0.019 |
31 |
|
[SO4]F:601 |
1 |
1 |
185 |
◊ |
[SO4]F:607 |
z,x,y |
5_555 |
4 |
1 |
185 |
16.3 |
-3.7 |
0.894 |
0 |
0 |
0 |
0.017 |
32 |
|
[SO4]F:605 |
3 |
1 |
185 |
f |
[SO4]F:607 |
z,x,y |
5_555 |
3 |
1 |
185 |
14.8 |
-3.5 |
0.992 |
0 |
0 |
0 |
0.016 |
33 |
|
[SO4]F:607 |
1 |
1 |
185 |
fx |
[SO4]F:607 |
z,x,y |
5_555 |
3 |
1 |
185 |
14.2 |
-3.4 |
0.891 |
0 |
0 |
0 |
0.016 |
34 |
|
[SO4]F:610 |
3 |
1 |
185 |
f |
[SO4]F:609 |
x,y,z |
1_555 |
1 |
1 |
186 |
11.7 |
-2.7 |
0.891 |
0 |
0 |
0 |
0.023 |
35 |
|
[SO4]F:601 |
1 |
1 |
185 |
◊ |
[SO4]F:605 |
z,x,y |
5_555 |
1 |
1 |
185 |
4.5 |
-1.1 |
0.800 |
0 |
0 |
0 |
0.005 |
36 |
|
F |
1 |
1 |
20959 |
◊ |
[SO4]F:611 |
z,x,y |
5_555 |
3 |
1 |
185 |
3.8 |
-0.5 |
0.563 |
0 |
0 |
0 |
0.003 |
37 |
|
[SO4]F:607 |
1 |
1 |
185 |
◊ |
F |
z,x,y |
5_555 |
2 |
1 |
20959 |
3.7 |
-0.4 |
0.623 |
0 |
0 |
0 |
0.002 |
38 |
|
[SO4]F:611 |
3 |
1 |
185 |
◊ |
F |
-z-1/4,-y-1/4,-x-1/4 |
24_444 |
1 |
1 |
20959 |
3.7 |
-0.5 |
0.565 |
0 |
0 |
0 |
0.003 |
39 |
|
[SO4]F:611 |
1 |
1 |
185 |
◊ |
F |
-x-1/4,-z-1/4,-y-1/4 |
19_444 |
1 |
1 |
20959 |
3.5 |
-0.5 |
0.533 |
0 |
0 |
0 |
0.003 |
40 |
|
[SO4]F:611 |
1 |
1 |
185 |
◊ |
F |
z,x,y |
5_555 |
1 |
1 |
20959 |
3.5 |
-0.5 |
0.538 |
0 |
0 |
0 |
0.003 |
41 |
|
[SO4]F:605 |
1 |
1 |
185 |
◊ |
[SO4]F:601 |
x,y,z |
1_555 |
1 |
1 |
185 |
2.9 |
-0.7 |
1.000 |
0 |
0 |
0 |
0.003 |
42 |
|
F |
1 |
1 |
20959 |
◊ |
F |
-x-1/4,-z-1/4,-y-1/4 |
19_444 |
1 |
1 |
20959 |
0.8 |
0.0 |
0.711 |
0 |
0 |
0 |
0.000 |
43 |
|
[SO4]F:611 |
2 |
1 |
185 |
◊ |
[SO4]F:611 |
-z-1/4,-y-1/4,-x-1/4 |
24_444 |
2 |
1 |
185 |
0.5 |
-0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
44 |
|
[SO4]F:611 |
2 |
1 |
185 |
x |
[SO4]F:611 |
z,x,y |
5_555 |
2 |
1 |
185 |
0.4 |
-0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
|