## |
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 |
102 |
25 |
10839 |
◊ |
A |
x,y,z |
1_555 |
121 |
34 |
10953 |
1045.0 |
-12.1 |
0.278 |
6 |
7 |
0 |
0.162 |
2 |
|
A |
97 |
23 |
10953 |
◊ |
B |
-y+2,x-y+2,z |
2_775 |
116 |
34 |
10839 |
1023.5 |
-15.0 |
0.147 |
7 |
7 |
0 |
0.162 |
Average: |
1034.3 |
-13.6 |
0.212 |
7 |
7 |
0 |
0.162 |
2 |
3 |
|
A |
61 |
20 |
10953 |
x |
A |
x,y,z-1 |
1_554 |
58 |
17 |
10953 |
662.8 |
-10.5 |
0.099 |
3 |
0 |
0 |
0.000 |
4 |
|
B |
61 |
18 |
10839 |
x |
B |
x,y,z-1 |
1_554 |
60 |
15 |
10839 |
639.6 |
-9.1 |
0.168 |
4 |
0 |
0 |
0.000 |
Average: |
651.2 |
-9.8 |
0.134 |
4 |
0 |
0 |
0.000 |
3 |
5 |
|
B |
66 |
21 |
10839 |
◊ |
A |
-y+1,x-y+1,z |
2_665 |
71 |
21 |
10953 |
601.5 |
-6.7 |
0.394 |
13 |
2 |
0 |
0.089 |
4 |
6 |
|
[SO4]A:408 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
10953 |
103.3 |
-14.3 |
0.624 |
2 |
0 |
0 |
0.106 |
5 |
7 |
|
[SO4]B:404 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
10839 |
95.8 |
-13.4 |
0.699 |
2 |
0 |
0 |
0.099 |
6 |
8 |
|
[SO4]A:401 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
10953 |
94.1 |
-15.0 |
0.788 |
6 |
0 |
0 |
0.123 |
7 |
9 |
|
[SO4]B:403 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
10839 |
93.7 |
-14.7 |
0.802 |
7 |
0 |
0 |
0.124 |
8 |
10 |
|
[SO4]B:407 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
10839 |
91.7 |
-13.0 |
0.793 |
1 |
0 |
0 |
0.094 |
9 |
11 |
|
[SO4]A:406 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
16 |
10 |
10839 |
83.5 |
-11.4 |
0.705 |
0 |
0 |
0 |
0.079 |
10 |
12 |
|
[SO4]A:409 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
10953 |
81.6 |
-10.9 |
0.724 |
0 |
0 |
0 |
0.076 |
11 |
13 |
|
[SO4]B:402 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
10839 |
62.9 |
-7.7 |
0.874 |
2 |
0 |
0 |
0.060 |
12 |
14 |
|
[SO4]A:405 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
10953 |
58.4 |
-7.2 |
0.882 |
2 |
0 |
0 |
0.056 |
13 |
15 |
|
[SO4]B:407 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
10953 |
53.0 |
-6.9 |
0.808 |
0 |
0 |
0 |
0.032 |
14 |
16 |
|
A |
6 |
2 |
10953 |
◊ |
B |
-y+2,x-y+2,z-1 |
2_774 |
4 |
2 |
10839 |
51.0 |
-0.7 |
0.377 |
0 |
0 |
0 |
0.000 |
17 |
|
B |
5 |
1 |
10839 |
◊ |
A |
x,y,z-1 |
1_554 |
3 |
2 |
10953 |
33.4 |
-0.9 |
0.309 |
0 |
0 |
0 |
0.000 |
Average: |
42.2 |
-0.8 |
0.343 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
[SO4]A:405 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
10839 |
48.6 |
-6.4 |
0.728 |
1 |
0 |
0 |
0.032 |
16 |
19 |
|
A |
6 |
3 |
10953 |
◊ |
[SO4]B:402 |
-y+2,x-y+2,z |
2_775 |
4 |
1 |
186 |
45.3 |
-6.0 |
0.762 |
1 |
0 |
0 |
0.030 |
17 |
20 |
|
A |
5 |
2 |
10953 |
◊ |
[SO4]A:408 |
x,y,z-1 |
1_554 |
4 |
1 |
187 |
42.6 |
-4.6 |
0.927 |
1 |
0 |
0 |
0.000 |
18 |
21 |
|
[SO4]A:409 |
5 |
1 |
185 |
◊ |
B |
-y+2,x-y+2,z |
2_775 |
5 |
3 |
10839 |
40.3 |
-4.3 |
0.884 |
1 |
0 |
0 |
0.022 |
19 |
22 |
|
B |
5 |
2 |
10839 |
◊ |
[SO4]B:404 |
x,y,z-1 |
1_554 |
4 |
1 |
184 |
39.5 |
-4.8 |
0.829 |
1 |
0 |
0 |
0.000 |
20 |
23 |
|
[SO4]A:406 |
5 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
10953 |
36.4 |
-3.8 |
0.886 |
0 |
0 |
0 |
0.018 |
21 |
24 |
|
[SO4]B:403 |
4 |
1 |
184 |
f |
[SO4]A:406 |
x,y,z |
1_555 |
3 |
1 |
186 |
30.6 |
-7.0 |
0.995 |
0 |
0 |
0 |
0.049 |
22 |
25 |
|
[SO4]A:409 |
3 |
1 |
185 |
f |
[SO4]A:401 |
x,y,z |
1_555 |
4 |
1 |
185 |
29.3 |
-6.7 |
0.995 |
0 |
0 |
0 |
0.046 |
23 |
26 |
|
A |
3 |
2 |
10953 |
◊ |
B |
x,y,z-1 |
1_554 |
2 |
1 |
10839 |
28.1 |
0.7 |
0.760 |
1 |
0 |
0 |
0.000 |
27 |
|
A |
2 |
1 |
10953 |
◊ |
B |
-y+2,x-y+2,z+1 |
2_776 |
3 |
2 |
10839 |
25.1 |
0.9 |
0.741 |
1 |
0 |
0 |
0.000 |
Average: |
26.6 |
0.8 |
0.750 |
1 |
0 |
0 |
0.000 |
24 |
28 |
|
[SO4]A:409 |
3 |
1 |
185 |
◊ |
[SO4]B:402 |
-y+2,x-y+2,z |
2_775 |
3 |
1 |
186 |
26.5 |
-6.3 |
0.992 |
0 |
0 |
0 |
0.029 |
25 |
29 |
|
[SO4]A:406 |
3 |
1 |
186 |
◊ |
[SO4]A:405 |
x,y,z |
1_555 |
2 |
1 |
186 |
25.5 |
-6.1 |
0.976 |
0 |
0 |
0 |
0.028 |
26 |
30 |
|
[SO4]B:403 |
3 |
1 |
184 |
◊ |
[SO4]A:405 |
x,y,z |
1_555 |
3 |
1 |
186 |
16.6 |
-3.7 |
0.992 |
0 |
0 |
0 |
0.017 |
27 |
31 |
|
[SO4]A:401 |
3 |
1 |
185 |
◊ |
[SO4]B:402 |
-y+2,x-y+2,z |
2_775 |
2 |
1 |
186 |
16.1 |
-3.8 |
0.976 |
0 |
0 |
0 |
0.018 |
28 |
32 |
|
[SO4]B:403 |
1 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
10953 |
4.3 |
-0.4 |
0.785 |
0 |
0 |
0 |
0.002 |
29 |
33 |
|
[SO4]A:401 |
1 |
1 |
185 |
◊ |
B |
-y+2,x-y+2,z |
2_775 |
1 |
1 |
10839 |
4.2 |
-0.4 |
0.878 |
0 |
0 |
0 |
0.002 |
|