## |
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 |
|
B |
256 |
66 |
13516 |
◊ |
A |
x,y,z |
1_555 |
263 |
66 |
13467 |
2604.9 |
-50.0 |
0.002 |
27 |
4 |
0 |
0.371 |
2 |
2 |
|
[NAP]A:301 |
47 |
1 |
891 |
f |
A |
x,y,z |
1_555 |
83 |
31 |
13467 |
613.9 |
-4.9 |
0.626 |
10 |
0 |
0 |
0.111 |
3 |
|
[NAP]B:301 |
48 |
1 |
885 |
f |
B |
x,y,z |
1_555 |
80 |
31 |
13516 |
611.6 |
-4.9 |
0.620 |
10 |
0 |
0 |
0.111 |
Average: |
612.8 |
-4.9 |
0.623 |
10 |
0 |
0 |
0.111 |
3 |
4 |
|
B |
43 |
14 |
13516 |
◊ |
A |
-y+1,-x+2,-z+1/4 |
8_675 |
43 |
14 |
13467 |
398.1 |
-5.2 |
0.366 |
3 |
0 |
0 |
0.000 |
4 |
5 |
|
A |
34 |
9 |
13467 |
◊ |
A |
-y+1,-x+1,-z+1/4 |
8_665 |
34 |
9 |
13467 |
343.2 |
-10.3 |
0.013 |
0 |
0 |
0 |
0.029 |
5 |
6 |
|
B |
32 |
9 |
13516 |
◊ |
B |
-y+1,-x+1,-z+1/4 |
8_665 |
32 |
9 |
13516 |
334.7 |
-9.6 |
0.022 |
0 |
0 |
0 |
0.027 |
6 |
7 |
|
[8KG]B:302 |
23 |
1 |
477 |
f |
B |
x,y,z |
1_555 |
53 |
21 |
13516 |
321.0 |
-1.4 |
0.492 |
1 |
0 |
0 |
0.024 |
8 |
|
[8KG]A:302 |
24 |
1 |
478 |
f |
A |
x,y,z |
1_555 |
53 |
20 |
13467 |
318.7 |
-1.4 |
0.490 |
2 |
0 |
0 |
0.024 |
Average: |
319.8 |
-1.4 |
0.491 |
2 |
0 |
0 |
0.024 |
7 |
9 |
|
A |
34 |
10 |
13467 |
◊ |
A |
x,-y+1,-z+1/2 |
6_565 |
34 |
10 |
13467 |
285.9 |
-0.5 |
0.770 |
4 |
0 |
0 |
0.000 |
8 |
10 |
|
B |
17 |
6 |
13516 |
◊ |
A |
x,-y+1,-z+1/2 |
6_565 |
11 |
3 |
13467 |
128.5 |
0.2 |
0.760 |
1 |
0 |
0 |
0.000 |
9 |
11 |
|
[SO4]A:303 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
13467 |
112.5 |
-17.9 |
0.752 |
4 |
0 |
0 |
0.117 |
10 |
12 |
|
[SO4]B:303 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
13516 |
111.7 |
-18.0 |
0.746 |
6 |
0 |
0 |
0.123 |
11 |
13 |
|
B |
15 |
5 |
13516 |
◊ |
B |
x,-y+1,-z+1/2 |
6_565 |
15 |
5 |
13516 |
105.9 |
0.2 |
0.756 |
2 |
0 |
0 |
0.000 |
12 |
14 |
|
B |
13 |
6 |
13516 |
◊ |
A |
-y+1,-x+1,-z+1/4 |
8_665 |
11 |
5 |
13467 |
105.4 |
-1.6 |
0.379 |
0 |
0 |
0 |
0.009 |
13 |
15 |
|
[SO4]A:305 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
13467 |
87.8 |
-12.3 |
0.828 |
3 |
0 |
0 |
0.081 |
14 |
16 |
|
[SO4]A:304 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
13467 |
86.8 |
-10.0 |
0.931 |
3 |
0 |
0 |
0.067 |
15 |
17 |
|
[8KG]A:302 |
11 |
1 |
478 |
f |
[NAP]A:301 |
x,y,z |
1_555 |
14 |
1 |
891 |
80.9 |
0.0 |
0.544 |
0 |
0 |
0 |
0.000 |
18 |
|
[8KG]B:302 |
11 |
1 |
477 |
f |
[NAP]B:301 |
x,y,z |
1_555 |
14 |
1 |
885 |
80.2 |
0.0 |
0.538 |
0 |
0 |
0 |
0.000 |
Average: |
80.6 |
0.0 |
0.541 |
0 |
0 |
0 |
0.000 |
16 |
19 |
|
[SO4]B:304 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
13516 |
80.8 |
-11.1 |
0.844 |
4 |
0 |
0 |
0.076 |
17 |
20 |
|
[8KG]A:302 |
2 |
1 |
478 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
13516 |
15.0 |
-0.1 |
0.509 |
0 |
0 |
0 |
0.001 |
21 |
|
[8KG]B:302 |
2 |
1 |
477 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
13467 |
13.6 |
-0.1 |
0.526 |
0 |
0 |
0 |
0.001 |
Average: |
14.3 |
-0.1 |
0.518 |
0 |
0 |
0 |
0.001 |
18 |
22 |
|
[SO4]B:303 |
4 |
1 |
185 |
f |
[NAP]B:301 |
x,y,z |
1_555 |
1 |
1 |
885 |
13.0 |
-2.1 |
0.288 |
0 |
0 |
0 |
0.012 |
19 |
23 |
|
[SO4]A:304 |
3 |
1 |
186 |
f |
[NAP]A:301 |
x,y,z |
1_555 |
3 |
1 |
891 |
11.8 |
-1.3 |
0.743 |
0 |
0 |
0 |
0.008 |
20 |
24 |
|
[SO4]A:303 |
4 |
1 |
185 |
f |
[NAP]A:301 |
x,y,z |
1_555 |
1 |
1 |
891 |
10.7 |
-1.5 |
0.326 |
0 |
0 |
0 |
0.009 |
|