| ## |
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 |
49 |
8 |
4734 |
◊ |
A |
x,y,z |
1_555 |
49 |
8 |
4694 |
372.6 |
-0.6 |
0.946 |
14 |
0 |
0 |
0.023 |
| 2 |
2 |
|
B |
39 |
7 |
4734 |
◊ |
B |
x,-y,-z |
4_555 |
39 |
7 |
4734 |
339.1 |
-11.7 |
0.567 |
2 |
0 |
0 |
0.059 |
| 3 |
3 |
|
[5BU]A:3 |
21 |
1 |
448 |
cf |
A |
x,y,z |
1_555 |
32 |
5 |
4694 |
237.7 |
1.7 |
0.866 |
1 |
0 |
0 |
0.000 |
| 4 |
4 |
|
[5BU]B:3 |
21 |
1 |
443 |
cf |
B |
x,y,z |
1_555 |
33 |
6 |
4734 |
234.7 |
1.4 |
0.850 |
2 |
0 |
0 |
0.000 |
| 5 |
5 |
|
[XXX]B:201 |
20 |
1 |
472 |
f |
B |
x,y,z |
1_555 |
29 |
9 |
4734 |
226.1 |
0.7 |
0.379 |
5 |
0 |
0 |
0.014 |
6 |
|
[XXX]A:101 |
20 |
1 |
470 |
f |
A |
x,y,z |
1_555 |
32 |
9 |
4694 |
213.7 |
0.8 |
0.323 |
5 |
0 |
0 |
0.014 |
| Average: |
219.9 |
0.7 |
0.351 |
5 |
0 |
0 |
0.014 |
| 6 |
7 |
|
B |
33 |
2 |
4734 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
31 |
2 |
4694 |
199.8 |
4.2 |
0.973 |
0 |
0 |
0 |
0.000 |
| 7 |
8 |
|
B |
19 |
4 |
4734 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
20 |
3 |
4694 |
143.3 |
-3.5 |
0.669 |
1 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[XXX]A:101 |
10 |
1 |
470 |
◊ |
B |
x,y,z |
1_555 |
15 |
4 |
4734 |
125.0 |
-1.7 |
0.471 |
3 |
0 |
0 |
0.018 |
10 |
|
[XXX]B:201 |
11 |
1 |
472 |
◊ |
A |
x,y,z |
1_555 |
14 |
3 |
4694 |
120.6 |
-1.4 |
0.458 |
2 |
0 |
0 |
0.018 |
| Average: |
122.8 |
-1.6 |
0.465 |
3 |
0 |
0 |
0.018 |
| 9 |
11 |
|
[K]B:24 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
4734 |
99.9 |
-64.0 |
0.000 |
0 |
0 |
0 |
0.599 |
12 |
|
[K]A:24 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
4694 |
97.2 |
-60.7 |
0.000 |
0 |
0 |
0 |
0.599 |
| Average: |
98.6 |
-62.4 |
0.000 |
0 |
0 |
0 |
0.599 |
| 10 |
13 |
|
A |
14 |
5 |
4694 |
x |
A |
x-1/2,-y+1/2,-z |
8_455 |
13 |
4 |
4694 |
98.5 |
-2.6 |
0.593 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
B |
14 |
2 |
4734 |
◊ |
A |
-x+2,y,-z+1/2 |
3_755 |
12 |
1 |
4694 |
97.6 |
1.8 |
0.850 |
2 |
0 |
0 |
0.000 |
| 12 |
15 |
|
B |
11 |
1 |
4734 |
◊ |
B |
-x+2,y,-z+1/2 |
3_755 |
11 |
1 |
4734 |
94.3 |
1.6 |
0.867 |
2 |
0 |
0 |
0.000 |
| 13 |
16 |
|
A |
12 |
1 |
4694 |
◊ |
A |
-x+3,y,-z+1/2 |
3_855 |
12 |
1 |
4694 |
86.4 |
3.3 |
0.935 |
0 |
0 |
0 |
0.000 |
| 14 |
17 |
|
[K]A:25 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
13 |
3 |
4694 |
85.6 |
-52.2 |
0.000 |
0 |
0 |
0 |
0.179 |
| 15 |
18 |
|
A |
12 |
2 |
4694 |
◊ |
[5BU]A:3 |
x-1/2,-y+1/2,-z |
8_455 |
7 |
1 |
448 |
81.8 |
-2.0 |
0.524 |
0 |
0 |
0 |
0.000 |
| 16 |
19 |
|
[K]B:24 |
1 |
1 |
216 |
f |
[5BU]B:3 |
x,y,z |
1_555 |
7 |
1 |
443 |
62.4 |
-32.5 |
0.000 |
0 |
0 |
0 |
0.304 |
20 |
|
[K]A:24 |
1 |
1 |
216 |
f |
[5BU]A:3 |
x,y,z |
1_555 |
5 |
1 |
448 |
60.1 |
-31.1 |
0.000 |
0 |
0 |
0 |
0.304 |
| Average: |
61.2 |
-31.8 |
0.000 |
0 |
0 |
0 |
0.304 |
| 17 |
21 |
|
[5BU]B:3 |
8 |
1 |
443 |
◊ |
B |
x,-y,-z |
4_555 |
7 |
4 |
4734 |
62.3 |
-1.9 |
0.477 |
0 |
0 |
0 |
0.017 |
| 18 |
22 |
|
[5BU]B:3 |
5 |
1 |
443 |
◊ |
[5BU]B:3 |
x,-y,-z |
4_555 |
5 |
1 |
443 |
61.9 |
-2.5 |
0.309 |
0 |
0 |
0 |
0.012 |
| 19 |
23 |
|
[XXX]A:101 |
8 |
1 |
470 |
f |
[K]A:25 |
x,y,z |
1_555 |
1 |
1 |
216 |
60.8 |
-31.6 |
0.000 |
0 |
0 |
0 |
0.108 |
| 20 |
24 |
|
[CL]A:26 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
5 |
4 |
4694 |
34.3 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.011 |
| 21 |
25 |
|
B |
3 |
3 |
4734 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
3 |
4694 |
24.3 |
-2.1 |
0.323 |
0 |
0 |
0 |
0.000 |
| 22 |
26 |
|
[XXX]B:201 |
3 |
1 |
472 |
◊ |
[XXX]A:101 |
x,y,z |
1_555 |
2 |
1 |
470 |
19.1 |
0.2 |
0.325 |
0 |
0 |
0 |
0.000 |
| 23 |
27 |
|
B |
3 |
3 |
4734 |
◊ |
[CL]A:26 |
x-1/2,y-1/2,z |
5_445 |
1 |
1 |
125 |
19.0 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 24 |
28 |
|
B |
4 |
2 |
4734 |
◊ |
A |
x-3/2,y-1/2,z |
5_345 |
4 |
1 |
4694 |
14.0 |
-1.4 |
0.476 |
0 |
0 |
0 |
0.000 |
| 25 |
29 |
|
[K]A:25 |
1 |
1 |
216 |
◊ |
B |
-x+2,y,-z+1/2 |
3_755 |
1 |
1 |
4734 |
5.9 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| 26 |
30 |
|
[K]A:25 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
4734 |
5.9 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.011 |
|