| ## |
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 |
93 |
24 |
12374 |
◊ |
A |
x,y,z |
1_555 |
98 |
21 |
12665 |
923.3 |
-11.6 |
0.064 |
11 |
1 |
0 |
0.231 |
| 2 |
2 |
|
A |
55 |
18 |
12665 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
66 |
19 |
12665 |
538.9 |
-2.2 |
0.454 |
0 |
0 |
0 |
0.000 |
| 3 |
3 |
|
[WAQ]A:700 |
32 |
1 |
700 |
f |
A |
x,y,z |
1_555 |
76 |
30 |
12665 |
435.9 |
2.4 |
0.558 |
11 |
0 |
0 |
0.059 |
4 |
|
[WAQ]B:700 |
33 |
1 |
700 |
f |
B |
x,y,z |
1_555 |
75 |
30 |
12374 |
435.9 |
3.1 |
0.607 |
11 |
0 |
0 |
0.059 |
| Average: |
435.9 |
2.7 |
0.582 |
11 |
0 |
0 |
0.059 |
| 4 |
5 |
|
B |
49 |
16 |
12374 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
51 |
13 |
12665 |
432.4 |
2.2 |
0.797 |
6 |
1 |
0 |
0.000 |
| 5 |
6 |
|
B |
28 |
7 |
12374 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
28 |
7 |
12665 |
255.2 |
-1.2 |
0.466 |
3 |
0 |
0 |
0.000 |
| 6 |
7 |
|
[PPV]A:701 |
9 |
1 |
258 |
f |
A |
x,y,z |
1_555 |
26 |
15 |
12665 |
121.5 |
-1.8 |
0.779 |
8 |
0 |
0 |
0.139 |
8 |
|
[PPV]B:701 |
9 |
1 |
259 |
f |
B |
x,y,z |
1_555 |
23 |
13 |
12374 |
121.2 |
-1.1 |
0.796 |
8 |
0 |
0 |
0.139 |
| Average: |
121.4 |
-1.4 |
0.787 |
8 |
0 |
0 |
0.139 |
| 7 |
9 |
|
B |
13 |
3 |
12374 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
11 |
2 |
12665 |
101.0 |
-0.8 |
0.433 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[PPV]B:701 |
6 |
1 |
259 |
f |
[WAQ]B:700 |
x,y,z |
1_555 |
9 |
1 |
700 |
64.4 |
-1.2 |
0.597 |
0 |
0 |
0 |
0.034 |
11 |
|
[PPV]A:701 |
6 |
1 |
258 |
f |
[WAQ]A:700 |
x,y,z |
1_555 |
9 |
1 |
700 |
64.1 |
-1.2 |
0.578 |
0 |
0 |
0 |
0.034 |
| Average: |
64.2 |
-1.2 |
0.588 |
0 |
0 |
0 |
0.034 |
| 9 |
12 |
|
B |
7 |
3 |
12374 |
x |
B |
x-1,y,z |
1_455 |
4 |
1 |
12374 |
38.4 |
0.4 |
0.727 |
1 |
1 |
0 |
0.000 |
| 10 |
13 |
|
[MG]A:703 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
12665 |
34.0 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.073 |
14 |
|
[MG]B:703 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
12374 |
32.4 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.073 |
| Average: |
33.2 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.073 |
| 11 |
15 |
|
[MG]A:704 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
12665 |
31.0 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.104 |
16 |
|
[MG]B:704 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
12374 |
30.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.104 |
| Average: |
30.9 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.104 |
| 12 |
17 |
|
B |
5 |
1 |
12374 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
2 |
12665 |
29.3 |
0.0 |
0.559 |
0 |
0 |
0 |
0.000 |
| 13 |
18 |
|
[MG]B:703 |
1 |
1 |
98 |
f |
[PPV]B:701 |
x,y,z |
1_555 |
4 |
1 |
259 |
28.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.111 |
19 |
|
[MG]A:703 |
1 |
1 |
98 |
f |
[PPV]A:701 |
x,y,z |
1_555 |
3 |
1 |
258 |
28.2 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.111 |
| Average: |
28.4 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.111 |
| 14 |
20 |
|
[MG]B:703 |
1 |
1 |
98 |
f |
[WAQ]B:700 |
x,y,z |
1_555 |
4 |
1 |
700 |
27.8 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.067 |
21 |
|
[MG]A:703 |
1 |
1 |
98 |
f |
[WAQ]A:700 |
x,y,z |
1_555 |
3 |
1 |
700 |
27.7 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.067 |
| Average: |
27.7 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.067 |
| 15 |
22 |
|
[MG]A:704 |
1 |
1 |
98 |
f |
[WAQ]A:700 |
x,y,z |
1_555 |
6 |
1 |
700 |
25.9 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.061 |
23 |
|
[MG]B:704 |
1 |
1 |
98 |
f |
[WAQ]B:700 |
x,y,z |
1_555 |
6 |
1 |
700 |
25.6 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.061 |
| Average: |
25.7 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.061 |
| 16 |
24 |
|
[MG]A:704 |
1 |
1 |
98 |
f |
[PPV]A:701 |
x,y,z |
1_555 |
3 |
1 |
258 |
25.6 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.104 |
25 |
|
[MG]B:704 |
1 |
1 |
98 |
f |
[PPV]B:701 |
x,y,z |
1_555 |
3 |
1 |
259 |
25.3 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.104 |
| Average: |
25.4 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.104 |
| 17 |
26 |
|
A |
2 |
1 |
12665 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
12665 |
3.8 |
-0.1 |
0.468 |
0 |
0 |
0 |
0.000 |
| 18 |
27 |
|
[MG]B:704 |
1 |
1 |
98 |
f |
[MG]B:703 |
x,y,z |
1_555 |
1 |
1 |
98 |
3.3 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.009 |
| 19 |
28 |
|
[MG]A:704 |
1 |
1 |
98 |
f |
[MG]A:703 |
x,y,z |
1_555 |
1 |
1 |
98 |
2.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.008 |
|