## |
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 |
|
E |
336 |
111 |
40352 |
◊ |
D |
x,y,z |
1_555 |
297 |
86 |
14058 |
2789.8 |
-2.7 |
0.937 |
41 |
2 |
0 |
0.628 |
2 |
|
B |
331 |
111 |
40082 |
◊ |
A |
x,y,z |
1_555 |
287 |
86 |
13877 |
2748.2 |
-6.4 |
0.858 |
40 |
3 |
0 |
0.628 |
Average: |
2769.0 |
-4.6 |
0.897 |
41 |
3 |
0 |
0.628 |
2 |
3 |
|
F |
166 |
45 |
11624 |
◊ |
D |
x,y,z |
1_555 |
168 |
56 |
14058 |
1697.1 |
-15.2 |
0.352 |
33 |
0 |
0 |
1.000 |
4 |
|
C |
171 |
46 |
11230 |
◊ |
A |
x,y,z |
1_555 |
173 |
53 |
13877 |
1693.2 |
-16.6 |
0.407 |
32 |
2 |
0 |
1.000 |
Average: |
1695.2 |
-15.9 |
0.379 |
33 |
1 |
0 |
1.000 |
3 |
5 |
|
F |
116 |
35 |
11624 |
◊ |
E |
x,y,z |
1_555 |
115 |
35 |
40352 |
1112.8 |
-3.0 |
0.745 |
14 |
6 |
0 |
0.149 |
6 |
|
C |
113 |
37 |
11230 |
◊ |
B |
x,y,z |
1_555 |
113 |
37 |
40082 |
1070.9 |
-5.8 |
0.659 |
14 |
5 |
0 |
0.149 |
Average: |
1091.9 |
-4.4 |
0.702 |
14 |
6 |
0 |
0.149 |
4 |
7 |
|
B |
64 |
24 |
40082 |
◊ |
E |
-x+1,y-1/2,-z+1 |
2_646 |
69 |
24 |
40352 |
586.3 |
-6.6 |
0.149 |
3 |
4 |
0 |
0.174 |
5 |
8 |
|
B |
44 |
15 |
40082 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
48 |
17 |
40082 |
460.5 |
-8.1 |
0.080 |
2 |
0 |
0 |
0.000 |
9 |
|
E |
41 |
13 |
40352 |
x |
E |
-x+1,y-1/2,-z |
2_645 |
42 |
15 |
40352 |
437.8 |
-7.7 |
0.061 |
3 |
0 |
0 |
0.000 |
Average: |
449.1 |
-7.9 |
0.071 |
3 |
0 |
0 |
0.000 |
6 |
10 |
|
A |
42 |
13 |
13877 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
39 |
15 |
40082 |
349.9 |
-2.7 |
0.493 |
5 |
0 |
0 |
0.000 |
11 |
|
D |
36 |
12 |
14058 |
◊ |
E |
-x,y-1/2,-z |
2_545 |
36 |
14 |
40352 |
335.0 |
-4.0 |
0.303 |
9 |
0 |
0 |
0.000 |
Average: |
342.5 |
-3.3 |
0.398 |
7 |
0 |
0 |
0.000 |
7 |
12 |
|
F |
32 |
12 |
11624 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
28 |
11 |
14058 |
234.6 |
-1.8 |
0.497 |
0 |
0 |
0 |
0.000 |
13 |
|
C |
34 |
12 |
11230 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
24 |
9 |
13877 |
233.3 |
-1.9 |
0.473 |
2 |
0 |
0 |
0.000 |
Average: |
234.0 |
-1.9 |
0.485 |
1 |
0 |
0 |
0.000 |
8 |
14 |
|
C |
20 |
5 |
11230 |
◊ |
E |
x,y,z |
1_555 |
21 |
6 |
40352 |
190.8 |
-0.1 |
0.671 |
4 |
0 |
0 |
0.000 |
9 |
15 |
|
C |
21 |
6 |
11230 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
15 |
6 |
40082 |
156.9 |
-3.0 |
0.152 |
0 |
0 |
0 |
0.000 |
16 |
|
F |
20 |
6 |
11624 |
◊ |
E |
-x,y-1/2,-z |
2_545 |
17 |
7 |
40352 |
152.9 |
-2.1 |
0.256 |
0 |
0 |
0 |
0.000 |
Average: |
154.9 |
-2.6 |
0.204 |
0 |
0 |
0 |
0.000 |
10 |
17 |
|
E |
24 |
9 |
40352 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
14 |
7 |
40082 |
156.3 |
0.6 |
0.751 |
2 |
2 |
0 |
0.000 |
11 |
18 |
|
F |
17 |
5 |
11624 |
◊ |
B |
x,y,z-1 |
1_554 |
22 |
8 |
40082 |
156.2 |
-1.7 |
0.464 |
0 |
0 |
0 |
0.000 |
12 |
19 |
|
B |
15 |
6 |
40082 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
13 |
3 |
40082 |
118.7 |
1.1 |
0.841 |
2 |
0 |
0 |
0.000 |
20 |
|
E |
11 |
4 |
40352 |
x |
E |
-x,y-1/2,-z |
2_545 |
13 |
3 |
40352 |
110.6 |
0.9 |
0.812 |
2 |
0 |
0 |
0.000 |
Average: |
114.6 |
1.0 |
0.826 |
2 |
0 |
0 |
0.000 |
13 |
21 |
|
[SO4]B:845 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
40082 |
98.7 |
-14.8 |
0.909 |
6 |
0 |
0 |
0.415 |
14 |
22 |
|
[SO4]B:844 |
5 |
1 |
185 |
f |
E |
-x+1,y-1/2,-z+1 |
2_646 |
10 |
6 |
40352 |
78.9 |
-11.2 |
0.850 |
3 |
0 |
0 |
0.372 |
15 |
23 |
|
[SO4]B:844 |
5 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
40082 |
70.4 |
-9.9 |
0.645 |
1 |
0 |
0 |
0.211 |
16 |
24 |
|
F |
4 |
2 |
11624 |
x |
F |
-x,y-1/2,-z |
2_545 |
4 |
1 |
11624 |
47.9 |
0.7 |
0.498 |
0 |
0 |
0 |
0.000 |
25 |
|
C |
5 |
2 |
11230 |
x |
C |
-x,y-1/2,-z+1 |
2_546 |
4 |
1 |
11230 |
44.3 |
0.4 |
0.494 |
0 |
0 |
0 |
0.000 |
Average: |
46.1 |
0.5 |
0.496 |
0 |
0 |
0 |
0.000 |
|