| ## |
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 |
243 |
64 |
17496 |
◊ |
A |
x,y,z |
1_555 |
237 |
63 |
16675 |
2319.5 |
-12.3 |
0.409 |
63 |
22 |
0 |
0.954 |
| 2 |
2 |
|
B |
85 |
24 |
17496 |
◊ |
B |
x-y,-y,-z |
8_555 |
85 |
24 |
17496 |
752.2 |
0.8 |
0.785 |
9 |
0 |
0 |
0.092 |
| 3 |
3 |
|
B |
75 |
21 |
17496 |
◊ |
B |
-y,-x,-z-1/6 |
10_554 |
73 |
21 |
17496 |
733.8 |
-2.3 |
0.583 |
6 |
8 |
0 |
0.006 |
| 4 |
4 |
|
A |
57 |
14 |
16675 |
x |
A |
x-y,-y+1,-z |
8_565 |
44 |
9 |
16675 |
439.8 |
3.8 |
0.888 |
7 |
3 |
0 |
0.000 |
| 5 |
5 |
|
B |
19 |
3 |
17496 |
◊ |
A |
x-y,x,z+1/6 |
6_555 |
28 |
7 |
16675 |
202.7 |
-1.3 |
0.471 |
2 |
0 |
0 |
0.000 |
| 6 |
6 |
|
B |
22 |
7 |
17496 |
x |
B |
x-y,x,z+1/6 |
6_555 |
14 |
5 |
17496 |
166.9 |
-1.5 |
0.320 |
1 |
0 |
0 |
0.000 |
| 7 |
7 |
|
B |
10 |
5 |
17496 |
◊ |
A |
-y,-x,-z-1/6 |
10_554 |
17 |
3 |
16675 |
122.0 |
-1.4 |
0.237 |
2 |
0 |
0 |
0.004 |
| 8 |
8 |
|
[ACT]A:504 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
27 |
11 |
16675 |
116.6 |
-0.5 |
0.622 |
1 |
0 |
0 |
0.022 |
| 9 |
9 |
|
[ACT]B:502 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
25 |
10 |
17496 |
115.3 |
-0.6 |
0.626 |
1 |
0 |
0 |
0.061 |
| 10 |
10 |
|
[EDO]B:501 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
16 |
5 |
16675 |
106.3 |
2.4 |
0.380 |
1 |
0 |
0 |
0.000 |
11 |
|
[EDO]A:501 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
15 |
5 |
17496 |
105.7 |
2.4 |
0.371 |
1 |
0 |
0 |
0.000 |
| Average: |
106.0 |
2.4 |
0.375 |
1 |
0 |
0 |
0.000 |
| 11 |
12 |
|
[EDO]A:503 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
16675 |
99.6 |
2.5 |
0.437 |
3 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[EDO]A:502 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
16675 |
90.0 |
2.8 |
0.309 |
5 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[EDO]A:501 |
3 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
16675 |
49.4 |
1.2 |
0.891 |
2 |
0 |
0 |
0.000 |
15 |
|
[EDO]B:501 |
3 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
17496 |
47.9 |
1.2 |
0.897 |
2 |
0 |
0 |
0.000 |
| Average: |
48.6 |
1.2 |
0.894 |
2 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[CA]B:504 |
1 |
1 |
85 |
x |
B |
x,y,z |
1_555 |
5 |
3 |
17496 |
39.4 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.502 |
| 15 |
17 |
|
[CA]B:505 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
17496 |
36.7 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.393 |
| 16 |
18 |
|
[EDO]A:502 |
2 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
17496 |
18.1 |
0.5 |
0.938 |
0 |
0 |
0 |
0.000 |
| 17 |
19 |
|
[CA]B:505 |
1 |
1 |
85 |
◊ |
B |
-y,-x,-z-1/6 |
10_554 |
3 |
1 |
17496 |
9.6 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.003 |
| 18 |
20 |
|
B |
1 |
1 |
17496 |
◊ |
A |
x,x-y+1,-z+1/6 |
12_565 |
1 |
1 |
16675 |
5.5 |
-0.2 |
0.308 |
0 |
0 |
0 |
0.000 |
|