| ## |
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 |
|
I |
184 |
52 |
12961 |
◊ |
M |
x,y,z |
1_555 |
195 |
53 |
11609 |
1730.6 |
-28.7 |
0.052 |
14 |
3 |
1 |
1.000 |
2 |
|
H |
183 |
51 |
13078 |
◊ |
L |
x,y,z |
1_555 |
192 |
53 |
11547 |
1688.4 |
-27.8 |
0.041 |
12 |
3 |
1 |
1.000 |
| Average: |
1709.5 |
-28.3 |
0.047 |
13 |
3 |
1 |
1.000 |
| 2 |
3 |
|
H |
49 |
16 |
13078 |
◊ |
L |
-x-1,y-1/2,-z+2 |
2_447 |
48 |
18 |
11547 |
471.9 |
-4.0 |
0.440 |
9 |
0 |
0 |
0.000 |
4 |
|
M |
43 |
16 |
11609 |
◊ |
I |
-x-1,y-1/2,-z+1 |
2_446 |
49 |
18 |
12961 |
458.8 |
-4.8 |
0.393 |
7 |
0 |
0 |
0.000 |
| Average: |
465.4 |
-4.4 |
0.417 |
8 |
0 |
0 |
0.000 |
| 3 |
5 |
|
H |
67 |
13 |
13078 |
◊ |
P |
x,y,z |
1_555 |
42 |
9 |
1226 |
456.7 |
-1.4 |
0.706 |
8 |
2 |
0 |
0.103 |
6 |
|
I |
64 |
12 |
12961 |
◊ |
Q |
x,y,z |
1_555 |
42 |
9 |
1146 |
427.7 |
-1.3 |
0.725 |
8 |
1 |
0 |
0.103 |
| Average: |
442.2 |
-1.4 |
0.715 |
8 |
2 |
0 |
0.103 |
| 4 |
7 |
|
I |
53 |
16 |
12961 |
◊ |
H |
x,y,z |
1_555 |
47 |
15 |
13078 |
451.3 |
2.9 |
0.919 |
8 |
0 |
0 |
0.006 |
| 5 |
8 |
|
L |
31 |
11 |
11547 |
x |
L |
-x,y-1/2,-z+2 |
2_547 |
25 |
7 |
11547 |
262.2 |
-3.2 |
0.331 |
1 |
0 |
0 |
0.000 |
| 6 |
9 |
|
I |
21 |
6 |
12961 |
◊ |
H |
x,y-1,z-1 |
1_544 |
21 |
6 |
13078 |
207.7 |
-4.5 |
0.153 |
0 |
0 |
0 |
0.000 |
| 7 |
10 |
|
I |
28 |
11 |
12961 |
◊ |
L |
x,y,z |
1_555 |
18 |
4 |
11547 |
191.8 |
-0.1 |
0.699 |
4 |
0 |
0 |
0.040 |
11 |
|
H |
27 |
11 |
13078 |
◊ |
M |
x,y,z |
1_555 |
19 |
4 |
11609 |
190.4 |
-0.5 |
0.633 |
4 |
0 |
0 |
0.040 |
| Average: |
191.1 |
-0.3 |
0.666 |
4 |
0 |
0 |
0.040 |
| 8 |
12 |
|
I |
19 |
6 |
12961 |
x |
I |
-x-1,y-1/2,-z+1 |
2_446 |
24 |
7 |
12961 |
169.4 |
-1.4 |
0.562 |
1 |
1 |
0 |
0.000 |
13 |
|
H |
23 |
7 |
13078 |
x |
H |
-x-1,y-1/2,-z+2 |
2_447 |
17 |
6 |
13078 |
160.7 |
-0.3 |
0.663 |
1 |
1 |
0 |
0.000 |
| Average: |
165.0 |
-0.9 |
0.613 |
1 |
1 |
0 |
0.000 |
| 9 |
14 |
|
L |
28 |
5 |
11547 |
◊ |
P |
x,y,z |
1_555 |
16 |
4 |
1226 |
167.8 |
-4.1 |
0.215 |
0 |
0 |
0 |
0.084 |
15 |
|
M |
26 |
5 |
11609 |
◊ |
Q |
x,y,z |
1_555 |
16 |
4 |
1146 |
166.0 |
-4.1 |
0.219 |
0 |
0 |
0 |
0.084 |
| Average: |
166.9 |
-4.1 |
0.217 |
0 |
0 |
0 |
0.084 |
| 10 |
16 |
|
L |
16 |
5 |
11547 |
◊ |
H |
-x-1,y-1/2,-z+2 |
2_447 |
13 |
4 |
13078 |
137.4 |
-0.7 |
0.555 |
3 |
0 |
0 |
0.000 |
17 |
|
I |
13 |
4 |
12961 |
◊ |
M |
-x-1,y-1/2,-z+1 |
2_446 |
15 |
3 |
11609 |
129.2 |
-0.5 |
0.586 |
2 |
0 |
0 |
0.000 |
| Average: |
133.3 |
-0.6 |
0.571 |
3 |
0 |
0 |
0.000 |
| 11 |
18 |
|
L |
17 |
8 |
11547 |
◊ |
H |
-x,y-1/2,-z+2 |
2_547 |
11 |
3 |
13078 |
126.9 |
-1.5 |
0.407 |
1 |
0 |
0 |
0.000 |
| 12 |
19 |
|
M |
17 |
5 |
11609 |
x |
M |
-x,y-1/2,-z+1 |
2_546 |
10 |
4 |
11609 |
102.4 |
0.3 |
0.732 |
0 |
0 |
0 |
0.000 |
| 13 |
20 |
|
M |
8 |
3 |
11609 |
◊ |
L |
x,y,z |
1_555 |
8 |
3 |
11547 |
74.3 |
1.4 |
0.876 |
2 |
0 |
0 |
0.000 |
| 14 |
21 |
|
I |
7 |
2 |
12961 |
x |
I |
x,y-1,z |
1_545 |
5 |
2 |
12961 |
51.6 |
-0.6 |
0.464 |
0 |
0 |
0 |
0.000 |
22 |
|
H |
4 |
2 |
13078 |
x |
H |
x,y-1,z |
1_545 |
6 |
2 |
13078 |
35.7 |
-0.1 |
0.439 |
0 |
0 |
0 |
0.000 |
| Average: |
43.6 |
-0.3 |
0.452 |
0 |
0 |
0 |
0.000 |
| 15 |
23 |
|
[SO4]H:218 |
4 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
10 |
5 |
13078 |
49.1 |
-5.3 |
0.842 |
2 |
0 |
0 |
0.126 |
| 16 |
24 |
|
[SO4]H:218 |
4 |
1 |
185 |
◊ |
L |
x,y,z |
1_555 |
5 |
2 |
11547 |
47.9 |
-4.9 |
0.896 |
1 |
0 |
0 |
0.108 |
| 17 |
25 |
|
[SO4]H:218 |
4 |
1 |
185 |
◊ |
I |
x,y,z |
1_555 |
7 |
4 |
12961 |
47.0 |
-5.3 |
0.860 |
2 |
0 |
0 |
0.059 |
| 18 |
26 |
|
[SO4]H:218 |
4 |
1 |
185 |
◊ |
M |
x,y,z |
1_555 |
5 |
2 |
11609 |
42.9 |
-4.4 |
0.910 |
1 |
0 |
0 |
0.047 |
| 19 |
27 |
|
I |
3 |
1 |
12961 |
◊ |
L |
x,y-1,z-1 |
1_544 |
2 |
1 |
11547 |
32.1 |
-0.4 |
0.393 |
0 |
0 |
0 |
0.000 |
28 |
|
M |
2 |
1 |
11609 |
◊ |
H |
x,y-1,z-1 |
1_544 |
3 |
1 |
13078 |
31.1 |
-0.1 |
0.557 |
1 |
0 |
0 |
0.000 |
| Average: |
31.6 |
-0.2 |
0.475 |
1 |
0 |
0 |
0.000 |
|