| ## |
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 |
43 |
14 |
6521 |
x |
A |
x,y,z-1 |
1_554 |
41 |
11 |
6521 |
367.6 |
1.0 |
0.534 |
1 |
1 |
0 |
0.000 |
2 |
|
A |
36 |
10 |
6521 |
x |
A |
x,y-1,z |
1_545 |
46 |
16 |
6521 |
345.5 |
0.5 |
0.434 |
1 |
0 |
0 |
0.000 |
3 |
|
A |
42 |
16 |
6521 |
x |
A |
x-1,y,z |
1_455 |
36 |
11 |
6521 |
309.1 |
2.6 |
0.693 |
1 |
0 |
0 |
0.000 |
4 |
|
A |
28 |
11 |
6521 |
x |
A |
x-1,y-1,z |
1_445 |
27 |
7 |
6521 |
235.5 |
-1.5 |
0.273 |
0 |
0 |
0 |
0.000 |
5 |
|
A |
21 |
6 |
6521 |
x |
A |
x-1,y,z-1 |
1_454 |
20 |
7 |
6521 |
184.2 |
0.8 |
0.576 |
0 |
1 |
0 |
0.000 |
6 |
|
A |
16 |
6 |
6521 |
x |
A |
x,y-1,z+1 |
1_546 |
15 |
5 |
6521 |
119.4 |
-0.6 |
0.396 |
0 |
0 |
0 |
0.000 |
7 |
|
[EDO]A:302 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
19 |
9 |
6521 |
112.5 |
3.8 |
0.420 |
1 |
0 |
0 |
0.000 |
8 |
|
[NO3]A:403 |
4 |
1 |
159 |
◊ |
A |
x,y,z |
1_555 |
11 |
7 |
6521 |
88.7 |
1.3 |
0.513 |
1 |
0 |
0 |
0.000 |
9 |
|
[NO3]A:401 |
4 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
6521 |
85.0 |
0.8 |
0.405 |
2 |
0 |
0 |
0.000 |
10 |
|
[NO3]A:404 |
4 |
1 |
160 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
6521 |
84.5 |
1.1 |
0.392 |
0 |
0 |
0 |
0.000 |
11 |
|
[EDO]A:303 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
15 |
3 |
6521 |
83.7 |
2.7 |
0.370 |
0 |
0 |
0 |
0.000 |
12 |
|
[ACT]A:201 |
4 |
1 |
176 |
◊ |
A |
x,y,z |
1_555 |
16 |
7 |
6521 |
83.0 |
0.1 |
0.659 |
1 |
0 |
0 |
0.000 |
13 |
|
[NO3]A:406 |
4 |
1 |
159 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
6521 |
73.3 |
1.1 |
0.513 |
2 |
0 |
0 |
0.000 |
14 |
|
[NO3]A:409 |
4 |
1 |
160 |
cf |
A |
x-1,y,z |
1_455 |
6 |
4 |
6521 |
71.8 |
1.0 |
0.508 |
0 |
0 |
0 |
0.000 |
15 |
|
[NO3]A:408 |
4 |
1 |
158 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
6521 |
70.7 |
1.2 |
0.433 |
2 |
0 |
0 |
0.000 |
16 |
|
[NO3]A:402 |
4 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
11 |
3 |
6521 |
66.4 |
0.9 |
0.424 |
2 |
0 |
0 |
0.000 |
17 |
|
[NO3]A:405 |
4 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
6521 |
66.3 |
1.1 |
0.447 |
2 |
0 |
0 |
0.000 |
18 |
|
[EDO]A:301 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
6521 |
60.1 |
1.7 |
0.243 |
1 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:301 |
4 |
1 |
184 |
◊ |
A |
x-1,y,z |
1_455 |
11 |
3 |
6521 |
59.5 |
1.7 |
0.779 |
0 |
0 |
0 |
0.000 |
20 |
|
[NO3]A:407 |
4 |
1 |
160 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
6521 |
56.2 |
0.5 |
0.364 |
1 |
0 |
0 |
0.000 |
21 |
|
[NO3]A:409 |
4 |
1 |
160 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
6521 |
49.9 |
0.7 |
0.411 |
0 |
0 |
0 |
0.000 |
22 |
|
A |
9 |
2 |
6521 |
◊ |
[NO3]A:406 |
x,y-1,z |
1_545 |
4 |
1 |
159 |
47.3 |
0.4 |
0.659 |
0 |
0 |
0 |
0.000 |
23 |
|
[ACT]A:201 |
4 |
1 |
176 |
f |
A |
x,y-1,z |
1_545 |
7 |
2 |
6521 |
46.9 |
-0.9 |
0.422 |
0 |
0 |
0 |
0.000 |
24 |
|
[NO3]A:408 |
4 |
1 |
158 |
◊ |
A |
x-1,y-1,z |
1_445 |
9 |
3 |
6521 |
46.7 |
0.9 |
0.821 |
0 |
0 |
0 |
0.000 |
25 |
|
[NO3]A:405 |
4 |
1 |
159 |
◊ |
A |
x,y,z-1 |
1_554 |
5 |
2 |
6521 |
45.0 |
0.7 |
0.820 |
0 |
0 |
0 |
0.000 |
26 |
|
A |
5 |
1 |
6521 |
f |
[NO3]A:407 |
x-1,y,z-1 |
1_454 |
4 |
1 |
160 |
44.7 |
-0.0 |
0.442 |
0 |
0 |
0 |
0.000 |
27 |
|
[EDO]A:301 |
3 |
1 |
184 |
f |
A |
x-1,y-1,z |
1_445 |
4 |
2 |
6521 |
40.9 |
0.2 |
0.333 |
0 |
0 |
0 |
0.000 |
28 |
|
A |
4 |
3 |
6521 |
◊ |
[NO3]A:402 |
x-1,y,z |
1_455 |
3 |
1 |
159 |
36.7 |
1.3 |
0.947 |
1 |
0 |
0 |
0.000 |
29 |
|
A |
4 |
2 |
6521 |
◊ |
[NO3]A:407 |
x,y,z-1 |
1_554 |
4 |
1 |
160 |
35.0 |
1.2 |
0.938 |
0 |
0 |
0 |
0.000 |
30 |
|
A |
3 |
1 |
6521 |
◊ |
[NO3]A:401 |
x,y-1,z |
1_545 |
3 |
1 |
159 |
32.8 |
0.8 |
0.906 |
0 |
0 |
0 |
0.000 |
31 |
|
A |
5 |
1 |
6521 |
◊ |
[NO3]A:402 |
x-1,y,z-1 |
1_454 |
4 |
1 |
159 |
26.9 |
0.1 |
0.613 |
0 |
0 |
0 |
0.000 |
32 |
|
[NO3]A:404 |
2 |
1 |
160 |
f |
[EDO]A:302 |
x,y,z |
1_555 |
2 |
1 |
182 |
21.0 |
0.9 |
1.000 |
0 |
0 |
0 |
0.000 |
33 |
|
[ACT]A:201 |
2 |
1 |
176 |
◊ |
A |
x-1,y-1,z |
1_445 |
1 |
1 |
6521 |
15.3 |
0.1 |
0.807 |
0 |
0 |
0 |
0.000 |
34 |
|
[NO3]A:405 |
3 |
1 |
159 |
◊ |
[NO3]A:407 |
x,y,z-1 |
1_554 |
3 |
1 |
160 |
15.0 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
35 |
|
[NO3]A:403 |
1 |
1 |
159 |
f |
A |
x-1,y,z-1 |
1_454 |
5 |
2 |
6521 |
13.0 |
0.2 |
0.762 |
0 |
0 |
0 |
0.000 |
36 |
|
[NO3]A:405 |
2 |
1 |
159 |
f |
[EDO]A:303 |
x,y,z |
1_555 |
2 |
1 |
183 |
10.3 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
37 |
|
A |
1 |
1 |
6521 |
f |
[NO3]A:406 |
x-1,y-1,z |
1_445 |
1 |
1 |
159 |
2.9 |
0.1 |
0.839 |
0 |
0 |
0 |
0.000 |
|