| ## |
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 |
|
H |
180 |
52 |
11617 |
◊ |
L |
x,y,z |
1_555 |
198 |
57 |
11589 |
1678.5 |
-28.5 |
0.024 |
9 |
2 |
0 |
0.200 |
2 |
|
H |
59 |
19 |
11617 |
◊ |
H |
x-y,-y,-z-1/3 |
5_554 |
59 |
19 |
11617 |
522.7 |
-5.6 |
0.455 |
6 |
0 |
0 |
0.031 |
3 |
|
L |
53 |
16 |
11589 |
◊ |
H |
-y,x-y-1,z+1/3 |
2_545 |
50 |
15 |
11617 |
487.8 |
-5.4 |
0.342 |
5 |
0 |
0 |
0.051 |
4 |
|
[STR]H:249 |
20 |
1 |
482 |
◊ |
H |
x,y,z |
1_555 |
42 |
10 |
11617 |
234.9 |
3.8 |
0.440 |
1 |
0 |
0 |
0.000 |
5 |
|
H |
24 |
9 |
11617 |
◊ |
H |
-x,-x+y,-z-2/3 |
6_554 |
24 |
9 |
11617 |
188.6 |
-0.7 |
0.700 |
4 |
0 |
0 |
0.000 |
6 |
|
H |
13 |
4 |
11617 |
◊ |
L |
x-y,-y,-z-1/3 |
5_554 |
17 |
6 |
11589 |
143.8 |
-0.6 |
0.585 |
1 |
0 |
0 |
0.006 |
7 |
|
L |
15 |
5 |
11589 |
◊ |
H |
y,x-1,-z-1 |
4_544 |
15 |
11 |
11617 |
121.0 |
0.9 |
0.653 |
1 |
0 |
0 |
0.000 |
8 |
|
[STR]H:249 |
11 |
1 |
482 |
◊ |
L |
x,y,z |
1_555 |
14 |
6 |
11589 |
110.7 |
2.1 |
0.391 |
0 |
0 |
0 |
0.000 |
9 |
|
L |
10 |
6 |
11589 |
x |
L |
-y,x-y-1,z+1/3 |
2_545 |
9 |
4 |
11589 |
99.6 |
-0.8 |
0.481 |
0 |
0 |
0 |
0.000 |
10 |
|
L |
6 |
3 |
11589 |
x |
L |
-y,x-y-1,z-2/3 |
2_544 |
12 |
3 |
11589 |
96.4 |
1.0 |
0.767 |
0 |
0 |
0 |
0.000 |
11 |
|
[SO4]H:248 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
9 |
3 |
11617 |
82.1 |
-11.7 |
0.727 |
3 |
0 |
0 |
0.097 |
12 |
|
[SO4]H:239 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
11 |
5 |
11617 |
80.7 |
-10.3 |
0.907 |
4 |
0 |
0 |
0.089 |
13 |
|
[SO4]H:240 |
5 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
8 |
6 |
11617 |
76.9 |
-8.5 |
0.976 |
3 |
0 |
0 |
0.073 |
14 |
|
[SO4]H:241 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
11 |
4 |
11617 |
71.1 |
-10.5 |
0.815 |
4 |
0 |
0 |
0.091 |
15 |
|
[SO4]L:216 |
4 |
1 |
185 |
f |
L |
x,y,z |
1_555 |
8 |
4 |
11589 |
70.3 |
-10.5 |
0.565 |
3 |
0 |
0 |
0.100 |
16 |
|
[SO4]H:243 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
8 |
3 |
11617 |
68.2 |
-9.3 |
0.799 |
1 |
0 |
0 |
0.072 |
17 |
|
[SO4]H:244 |
4 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
13 |
5 |
11617 |
67.2 |
-9.7 |
0.761 |
1 |
0 |
0 |
0.075 |
18 |
|
[SO4]H:242 |
4 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
8 |
4 |
11617 |
65.9 |
-9.0 |
0.662 |
1 |
0 |
0 |
0.070 |
19 |
|
[SO4]H:245 |
5 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
7 |
4 |
11617 |
64.4 |
-6.5 |
0.964 |
1 |
0 |
0 |
0.051 |
20 |
|
[SO4]L:215 |
4 |
1 |
185 |
f |
H |
y,x-1,-z-1 |
4_544 |
10 |
4 |
11617 |
63.7 |
-9.2 |
0.766 |
1 |
0 |
0 |
0.071 |
21 |
|
[SO4]H:247 |
4 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
6 |
2 |
11617 |
61.5 |
-7.9 |
0.791 |
3 |
0 |
0 |
0.068 |
22 |
|
L |
12 |
7 |
11589 |
◊ |
[SO4]H:239 |
-y,x-y-1,z+1/3 |
2_545 |
4 |
1 |
185 |
60.2 |
-7.9 |
0.822 |
2 |
0 |
0 |
0.059 |
23 |
|
[SO4]H:201 |
4 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
10 |
4 |
11617 |
58.4 |
-8.0 |
0.756 |
1 |
0 |
0 |
0.063 |
24 |
|
[SO4]H:246 |
5 |
1 |
184 |
◊ |
H |
x,y,z |
1_555 |
10 |
4 |
11617 |
58.2 |
-7.6 |
0.787 |
2 |
0 |
0 |
0.063 |
25 |
|
[SO4]H:246 |
4 |
1 |
184 |
◊ |
H |
x-y,-y,-z-1/3 |
5_554 |
11 |
6 |
11617 |
56.8 |
-7.5 |
0.757 |
2 |
0 |
0 |
0.062 |
26 |
|
[SO4]H:247 |
4 |
1 |
185 |
◊ |
L |
x,y,z |
1_555 |
8 |
5 |
11589 |
56.3 |
-6.3 |
0.863 |
0 |
0 |
0 |
0.039 |
27 |
|
[SO4]H:246 |
5 |
1 |
184 |
f |
[SO4]H:246 |
x-y,-y,-z-1/3 |
5_554 |
5 |
1 |
184 |
54.2 |
-11.8 |
0.993 |
0 |
0 |
0 |
0.100 |
28 |
|
[SO4]L:215 |
5 |
1 |
185 |
◊ |
L |
x,y,z |
1_555 |
8 |
3 |
11589 |
50.3 |
-5.2 |
0.940 |
1 |
0 |
0 |
0.000 |
29 |
|
[STR]H:249 |
6 |
1 |
482 |
◊ |
L |
x-y,-y,-z-1/3 |
5_554 |
5 |
3 |
11589 |
47.6 |
0.3 |
0.304 |
0 |
0 |
0 |
0.000 |
30 |
|
L |
5 |
2 |
11589 |
◊ |
[SO4]H:247 |
-y,x-y-1,z+1/3 |
2_545 |
4 |
1 |
185 |
42.5 |
-5.9 |
0.591 |
0 |
0 |
0 |
0.039 |
31 |
|
L |
3 |
1 |
11589 |
◊ |
[SO4]H:245 |
-y,x-y-1,z+1/3 |
2_545 |
3 |
1 |
186 |
34.5 |
-4.2 |
0.671 |
1 |
0 |
0 |
0.031 |
32 |
|
[SO4]L:216 |
4 |
1 |
185 |
◊ |
L |
-y,x-y-1,z+1/3 |
2_545 |
5 |
2 |
11589 |
33.1 |
-4.4 |
0.613 |
0 |
0 |
0 |
0.000 |
33 |
|
[STR]H:249 |
5 |
1 |
482 |
f |
H |
x-y,-y,-z-1/3 |
5_554 |
5 |
2 |
11617 |
29.7 |
-0.6 |
0.188 |
0 |
0 |
0 |
0.004 |
34 |
|
H |
3 |
1 |
11617 |
x |
H |
y,x-1,-z-1 |
4_544 |
4 |
1 |
11617 |
16.9 |
-0.2 |
0.562 |
0 |
0 |
0 |
0.000 |
35 |
|
[SO4]H:248 |
1 |
1 |
185 |
◊ |
L |
x,y,z |
1_555 |
2 |
1 |
11589 |
15.0 |
-2.1 |
0.503 |
0 |
0 |
0 |
0.013 |
36 |
|
L |
2 |
1 |
11589 |
◊ |
L |
x-y,-y,-z-1/3 |
5_554 |
2 |
1 |
11589 |
9.5 |
-0.2 |
0.433 |
0 |
0 |
0 |
0.000 |
|