| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
A |
110 |
35 |
16254 |
x |
A |
x-1,y,z |
1_455 |
126 |
49 |
16254 |
1059.3 |
-9.8 |
0.383 |
5 |
6 |
0 |
0.000 |
2 |
|
A |
62 |
15 |
16254 |
x |
A |
-x-1,y-1/2,-z+1/2 |
3_445 |
65 |
20 |
16254 |
571.2 |
-3.0 |
0.596 |
6 |
2 |
0 |
0.000 |
3 |
|
A |
47 |
15 |
16254 |
x |
A |
-x+1/2,-y,z-1/2 |
2_554 |
50 |
12 |
16254 |
424.9 |
-1.9 |
0.610 |
5 |
0 |
0 |
0.000 |
4 |
|
A |
17 |
7 |
16254 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
13 |
4 |
16254 |
147.9 |
1.5 |
0.621 |
3 |
4 |
0 |
0.000 |
5 |
|
[EDO]A:3014 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
19 |
6 |
16254 |
108.9 |
3.0 |
0.503 |
3 |
0 |
0 |
0.000 |
6 |
|
[EDO]A:3005 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
17 |
10 |
16254 |
108.1 |
2.7 |
0.475 |
4 |
0 |
0 |
0.000 |
7 |
|
[SO4]A:1002 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
16254 |
102.6 |
-15.8 |
0.849 |
4 |
0 |
0 |
0.048 |
8 |
|
[EDO]A:3004 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
16254 |
99.5 |
3.4 |
0.510 |
4 |
0 |
0 |
0.000 |
9 |
|
[EDO]A:3003 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
16254 |
92.3 |
2.6 |
0.449 |
4 |
0 |
0 |
0.000 |
10 |
|
[EDO]A:3001 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
16254 |
91.5 |
2.1 |
0.271 |
2 |
0 |
0 |
0.000 |
11 |
|
[SO4]A:1000 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
16254 |
89.0 |
-11.7 |
0.933 |
6 |
0 |
0 |
0.039 |
12 |
|
[EDO]A:3002 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
16254 |
83.6 |
2.2 |
0.460 |
4 |
0 |
0 |
0.000 |
13 |
|
[EDO]A:3006 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
16254 |
83.4 |
1.8 |
0.235 |
0 |
0 |
0 |
0.000 |
14 |
|
[EDO]A:3011 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
16254 |
74.4 |
1.8 |
0.856 |
4 |
0 |
0 |
0.000 |
15 |
|
[SO4]A:1001 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
16254 |
73.1 |
-10.2 |
0.796 |
2 |
0 |
0 |
0.030 |
16 |
|
[EDO]A:3008 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
11 |
6 |
16254 |
72.9 |
1.6 |
0.232 |
1 |
0 |
0 |
0.000 |
17 |
|
[EDO]A:3007 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
16254 |
72.0 |
1.9 |
0.289 |
2 |
0 |
0 |
0.000 |
18 |
|
[EDO]A:3009 |
4 |
1 |
185 |
◊ |
A |
x-1,y,z |
1_455 |
11 |
4 |
16254 |
71.3 |
1.9 |
0.870 |
1 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:3007 |
4 |
1 |
182 |
f |
A |
x-1,y,z |
1_455 |
13 |
5 |
16254 |
69.9 |
1.3 |
0.701 |
1 |
0 |
0 |
0.000 |
20 |
|
[EDO]A:3012 |
3 |
1 |
184 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
9 |
4 |
16254 |
65.0 |
1.5 |
0.249 |
0 |
0 |
0 |
0.000 |
21 |
|
A |
11 |
4 |
16254 |
◊ |
[SO4]A:1001 |
x-1,y,z |
1_455 |
5 |
1 |
186 |
61.8 |
-7.9 |
0.847 |
0 |
0 |
0 |
0.000 |
22 |
|
A |
8 |
3 |
16254 |
f |
[EDO]A:3008 |
x-1,y,z |
1_455 |
4 |
1 |
182 |
60.3 |
1.5 |
0.816 |
3 |
0 |
0 |
0.000 |
23 |
|
[EDO]A:3009 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
16254 |
60.0 |
1.3 |
0.750 |
2 |
0 |
0 |
0.000 |
24 |
|
[EDO]A:3010 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
16254 |
59.5 |
1.7 |
0.820 |
1 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:3012 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
16254 |
59.2 |
1.8 |
0.299 |
1 |
0 |
0 |
0.000 |
26 |
|
A |
4 |
1 |
16254 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
8 |
3 |
16254 |
57.5 |
0.5 |
0.754 |
0 |
0 |
0 |
0.000 |
27 |
|
A |
5 |
3 |
16254 |
x |
A |
-x-2,y-1/2,-z+1/2 |
3_345 |
3 |
1 |
16254 |
55.4 |
0.9 |
0.866 |
1 |
2 |
0 |
0.000 |
28 |
|
A |
8 |
3 |
16254 |
x |
A |
-x-1/2,-y,z-1/2 |
2_454 |
9 |
4 |
16254 |
54.6 |
-0.4 |
0.534 |
0 |
0 |
0 |
0.000 |
29 |
|
A |
12 |
2 |
16254 |
◊ |
[EDO]A:3002 |
-x-1,y-1/2,-z+1/2 |
3_445 |
4 |
1 |
186 |
53.0 |
1.3 |
0.243 |
0 |
0 |
0 |
0.000 |
30 |
|
A |
8 |
2 |
16254 |
◊ |
[EDO]A:3003 |
x-1,y,z |
1_455 |
3 |
1 |
186 |
46.6 |
0.9 |
0.676 |
0 |
0 |
0 |
0.000 |
31 |
|
[EDO]A:3006 |
4 |
1 |
185 |
f |
A |
x-1,y,z |
1_455 |
7 |
2 |
16254 |
45.7 |
1.3 |
0.853 |
0 |
0 |
0 |
0.000 |
32 |
|
A |
6 |
2 |
16254 |
x |
A |
x-5/2,-y-1/2,-z |
4_245 |
5 |
1 |
16254 |
41.8 |
-0.1 |
0.602 |
1 |
0 |
0 |
0.000 |
33 |
|
[SO4]A:1000 |
4 |
1 |
184 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
7 |
2 |
16254 |
41.4 |
-5.1 |
0.747 |
1 |
0 |
0 |
0.000 |
34 |
|
A |
5 |
1 |
16254 |
◊ |
[EDO]A:3011 |
x-1,y,z |
1_455 |
3 |
1 |
186 |
37.8 |
1.1 |
0.755 |
0 |
0 |
0 |
0.000 |
35 |
|
[EDO]A:3010 |
3 |
1 |
186 |
f |
A |
x-1,y,z |
1_455 |
4 |
2 |
16254 |
31.6 |
0.6 |
0.849 |
1 |
0 |
0 |
0.000 |
36 |
|
[SO4]A:1000 |
3 |
1 |
184 |
◊ |
A |
-x-1,y-1/2,-z+1/2 |
3_445 |
5 |
4 |
16254 |
25.2 |
-3.4 |
0.599 |
0 |
0 |
0 |
0.000 |
37 |
|
A |
4 |
3 |
16254 |
◊ |
[EDO]A:3014 |
x-1,y,z |
1_455 |
3 |
1 |
185 |
23.1 |
0.7 |
0.828 |
0 |
0 |
0 |
0.000 |
38 |
|
[EDO]A:3014 |
2 |
1 |
185 |
f |
A |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
16254 |
18.8 |
0.0 |
0.390 |
0 |
0 |
0 |
0.000 |
39 |
|
[EDO]A:3012 |
1 |
1 |
184 |
f |
[EDO]A:3002 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
186 |
13.9 |
0.3 |
1.000 |
1 |
0 |
0 |
0.000 |
40 |
|
[EDO]A:3011 |
1 |
1 |
186 |
◊ |
[EDO]A:3008 |
x,y,z |
1_555 |
1 |
1 |
182 |
12.9 |
0.9 |
1.000 |
0 |
0 |
0 |
0.000 |
41 |
|
[EDO]A:3014 |
1 |
1 |
185 |
◊ |
[EDO]A:3012 |
x,y,z |
1_555 |
1 |
1 |
184 |
9.4 |
0.6 |
1.000 |
0 |
0 |
0 |
0.000 |
42 |
|
A |
1 |
1 |
16254 |
f |
[EDO]A:3005 |
-x-1,y-1/2,-z+1/2 |
3_445 |
1 |
1 |
186 |
8.0 |
-0.0 |
0.538 |
0 |
0 |
0 |
0.000 |
43 |
|
A |
1 |
1 |
16254 |
x |
A |
-x+3/2,-y,z-1/2 |
2_654 |
1 |
1 |
16254 |
5.3 |
-0.2 |
0.356 |
0 |
0 |
0 |
0.000 |
44 |
|
[EDO]A:3012 |
1 |
1 |
184 |
f |
A |
-x-1,y-1/2,-z+1/2 |
3_445 |
1 |
1 |
16254 |
0.3 |
0.0 |
0.810 |
0 |
0 |
0 |
0.000 |
|