## |
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 |
100 |
24 |
6631 |
◊ |
M |
x,y,z |
1_555 |
101 |
26 |
5972 |
855.1 |
-13.4 |
0.144 |
5 |
0 |
0 |
0.448 |
2 |
|
H |
97 |
23 |
6609 |
◊ |
L |
x,y,z |
1_555 |
97 |
27 |
5856 |
835.7 |
-13.3 |
0.101 |
6 |
0 |
0 |
0.448 |
Average: |
845.4 |
-13.3 |
0.123 |
6 |
0 |
0 |
0.448 |
2 |
3 |
|
L |
51 |
19 |
5856 |
◊ |
L |
-x+1,-y,z |
2_655 |
51 |
19 |
5856 |
543.8 |
-4.3 |
0.383 |
12 |
0 |
0 |
0.000 |
4 |
|
M |
54 |
19 |
5972 |
◊ |
M |
-x+1,-y,z |
2_655 |
55 |
20 |
5972 |
534.7 |
-4.9 |
0.424 |
12 |
0 |
0 |
0.000 |
Average: |
539.3 |
-4.6 |
0.404 |
12 |
0 |
0 |
0.000 |
3 |
5 |
|
I |
56 |
15 |
6631 |
◊ |
B |
x,y,z |
1_555 |
47 |
15 |
5173 |
429.8 |
-3.2 |
0.533 |
3 |
1 |
0 |
0.000 |
6 |
|
H |
55 |
14 |
6609 |
◊ |
A |
x,y,z |
1_555 |
49 |
15 |
5179 |
419.5 |
-2.9 |
0.561 |
5 |
4 |
0 |
0.000 |
Average: |
424.6 |
-3.0 |
0.547 |
4 |
3 |
0 |
0.000 |
4 |
7 |
|
M |
40 |
15 |
5972 |
◊ |
L |
-x+1,-y,z-1 |
2_654 |
38 |
14 |
5856 |
358.4 |
-1.1 |
0.655 |
14 |
0 |
0 |
0.000 |
5 |
8 |
|
M |
34 |
11 |
5972 |
◊ |
B |
x,y,z |
1_555 |
34 |
14 |
5173 |
327.2 |
-3.6 |
0.370 |
6 |
0 |
0 |
0.000 |
9 |
|
L |
30 |
10 |
5856 |
◊ |
A |
x,y,z |
1_555 |
29 |
14 |
5179 |
306.6 |
-3.5 |
0.312 |
7 |
0 |
0 |
0.000 |
Average: |
316.9 |
-3.6 |
0.341 |
7 |
0 |
0 |
0.000 |
6 |
10 |
|
H |
31 |
11 |
6609 |
◊ |
B |
x,y,z |
1_555 |
31 |
13 |
5173 |
311.9 |
-2.5 |
0.452 |
3 |
0 |
0 |
0.000 |
11 |
|
I |
37 |
11 |
6631 |
◊ |
A |
x,y,z |
1_555 |
33 |
15 |
5179 |
296.9 |
-2.4 |
0.497 |
1 |
0 |
0 |
0.000 |
Average: |
304.4 |
-2.5 |
0.475 |
2 |
0 |
0 |
0.000 |
7 |
12 |
|
B |
36 |
10 |
5173 |
◊ |
I |
x-1/2,-y-1/2,-z-1 |
4_444 |
30 |
12 |
6631 |
286.1 |
0.7 |
0.755 |
11 |
0 |
0 |
0.000 |
8 |
13 |
|
H |
24 |
8 |
6609 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
17 |
5 |
5179 |
165.7 |
-1.6 |
0.488 |
1 |
0 |
0 |
0.000 |
9 |
14 |
|
M |
18 |
5 |
5972 |
◊ |
L |
x,y,z-1 |
1_554 |
19 |
6 |
5856 |
164.1 |
4.0 |
0.963 |
2 |
0 |
0 |
0.000 |
10 |
15 |
|
B |
13 |
3 |
5173 |
◊ |
A |
x,y,z |
1_555 |
16 |
3 |
5179 |
103.9 |
-0.1 |
0.692 |
2 |
0 |
0 |
0.000 |
11 |
16 |
|
M |
11 |
4 |
5972 |
◊ |
B |
-x+1,-y,z |
2_655 |
11 |
5 |
5173 |
103.9 |
-1.6 |
0.354 |
1 |
0 |
0 |
0.000 |
17 |
|
L |
11 |
4 |
5856 |
◊ |
A |
-x+1,-y,z |
2_655 |
11 |
5 |
5179 |
103.8 |
-1.5 |
0.356 |
1 |
0 |
0 |
0.000 |
Average: |
103.8 |
-1.6 |
0.355 |
1 |
0 |
0 |
0.000 |
12 |
18 |
|
[SO4]L:201 |
5 |
1 |
186 |
f |
L |
x,y,z |
1_555 |
15 |
6 |
5856 |
101.1 |
-14.1 |
0.849 |
2 |
0 |
0 |
0.421 |
13 |
19 |
|
[SO4]M:201 |
5 |
1 |
187 |
f |
M |
x,y,z |
1_555 |
15 |
5 |
5972 |
99.6 |
-14.9 |
0.849 |
3 |
0 |
0 |
0.440 |
14 |
20 |
|
I |
12 |
3 |
6631 |
◊ |
H |
x,y,z |
1_555 |
9 |
2 |
6609 |
97.7 |
1.4 |
0.860 |
0 |
0 |
0 |
0.000 |
15 |
21 |
|
H |
9 |
4 |
6609 |
◊ |
A |
x-1,y,z |
1_455 |
14 |
6 |
5179 |
90.5 |
-0.2 |
0.657 |
0 |
0 |
0 |
0.000 |
22 |
|
B |
9 |
4 |
5173 |
◊ |
I |
x-1,y,z |
1_455 |
7 |
2 |
6631 |
59.1 |
-0.2 |
0.600 |
0 |
0 |
0 |
0.000 |
Average: |
74.8 |
-0.2 |
0.629 |
0 |
0 |
0 |
0.000 |
16 |
23 |
|
[SO4]M:201 |
4 |
1 |
187 |
◊ |
I |
x,y,z |
1_555 |
5 |
1 |
6631 |
38.6 |
-4.6 |
0.825 |
1 |
0 |
0 |
0.137 |
17 |
24 |
|
[SO4]L:201 |
4 |
1 |
186 |
◊ |
H |
x,y,z |
1_555 |
5 |
1 |
6609 |
37.1 |
-4.2 |
0.838 |
1 |
0 |
0 |
0.131 |
18 |
25 |
|
I |
1 |
1 |
6631 |
◊ |
H |
-x+1,-y,z |
2_655 |
1 |
1 |
6609 |
1.5 |
0.0 |
0.707 |
0 |
0 |
0 |
0.000 |
|