| ## |
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 |
84 |
21 |
6499 |
◊ |
A |
x,y,z |
1_555 |
93 |
25 |
6361 |
831.4 |
-7.7 |
0.345 |
17 |
0 |
0 |
0.638 |
2 |
|
D |
85 |
20 |
6454 |
◊ |
C |
x,y,z |
1_555 |
82 |
22 |
6345 |
802.0 |
-8.1 |
0.325 |
22 |
3 |
0 |
0.638 |
| Average: |
816.7 |
-7.9 |
0.335 |
20 |
2 |
0 |
0.638 |
| 2 |
3 |
|
B |
50 |
16 |
6499 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
53 |
17 |
6454 |
460.7 |
-3.2 |
0.512 |
4 |
1 |
0 |
0.000 |
4 |
|
A |
47 |
12 |
6361 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
50 |
14 |
6499 |
412.0 |
-1.5 |
0.648 |
6 |
1 |
0 |
0.000 |
| Average: |
436.3 |
-2.4 |
0.580 |
5 |
1 |
0 |
0.000 |
| 3 |
5 |
|
A |
50 |
17 |
6361 |
◊ |
C |
-x-1/2,-y,z-1/2 |
2_454 |
46 |
14 |
6345 |
404.4 |
-1.8 |
0.606 |
7 |
2 |
0 |
0.000 |
6 |
|
C |
48 |
18 |
6345 |
◊ |
D |
x-1/2,-y-1/2,-z+1 |
4_446 |
39 |
14 |
6454 |
394.1 |
-3.1 |
0.506 |
5 |
2 |
0 |
0.000 |
| Average: |
399.2 |
-2.4 |
0.556 |
6 |
2 |
0 |
0.000 |
| 4 |
7 |
|
C |
38 |
16 |
6345 |
◊ |
A |
x,y,z |
1_555 |
39 |
16 |
6361 |
388.6 |
-7.8 |
0.061 |
2 |
0 |
0 |
0.089 |
| 5 |
8 |
|
D |
30 |
14 |
6454 |
◊ |
B |
x,y,z |
1_555 |
29 |
13 |
6499 |
320.4 |
-5.9 |
0.119 |
2 |
0 |
0 |
0.069 |
| 6 |
9 |
|
D |
34 |
9 |
6454 |
◊ |
A |
x,y,z |
1_555 |
38 |
11 |
6361 |
295.0 |
-5.2 |
0.189 |
4 |
0 |
0 |
0.348 |
10 |
|
C |
34 |
10 |
6345 |
◊ |
B |
x,y,z |
1_555 |
31 |
9 |
6499 |
290.0 |
-5.2 |
0.180 |
4 |
0 |
0 |
0.348 |
| Average: |
292.5 |
-5.2 |
0.185 |
4 |
0 |
0 |
0.348 |
| 7 |
11 |
|
B |
20 |
5 |
6499 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
20 |
6 |
6454 |
183.0 |
-0.8 |
0.587 |
2 |
0 |
0 |
0.000 |
| 8 |
12 |
|
C |
16 |
6 |
6345 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
16 |
5 |
6361 |
113.7 |
-0.0 |
0.685 |
1 |
0 |
0 |
0.000 |
| 9 |
13 |
|
[MPD]A:201 |
7 |
1 |
273 |
◊ |
C |
x,y,z |
1_555 |
17 |
7 |
6345 |
93.2 |
-6.1 |
0.640 |
0 |
0 |
0 |
0.305 |
14 |
|
[MPD]D:201 |
7 |
1 |
273 |
◊ |
A |
x,y,z |
1_555 |
16 |
7 |
6361 |
92.4 |
-6.0 |
0.610 |
0 |
0 |
0 |
0.305 |
| Average: |
92.8 |
-6.1 |
0.625 |
0 |
0 |
0 |
0.305 |
| 10 |
15 |
|
[MPD]A:201 |
6 |
1 |
273 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
6499 |
90.2 |
-6.1 |
0.671 |
2 |
0 |
0 |
0.348 |
16 |
|
[MPD]D:201 |
6 |
1 |
273 |
f |
D |
x,y,z |
1_555 |
20 |
7 |
6454 |
89.8 |
-6.1 |
0.682 |
2 |
0 |
0 |
0.348 |
| Average: |
90.0 |
-6.1 |
0.677 |
2 |
0 |
0 |
0.348 |
| 11 |
17 |
|
A |
6 |
2 |
6361 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
2 |
6454 |
37.6 |
-0.6 |
0.409 |
0 |
0 |
0 |
0.000 |
| 12 |
18 |
|
[MG]B:201 |
1 |
1 |
98 |
f |
D |
-x+1/2,-y,z-1/2 |
2_554 |
7 |
4 |
6454 |
36.9 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.170 |
| 13 |
19 |
|
[MPD]D:201 |
3 |
1 |
273 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
6345 |
31.8 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.073 |
20 |
|
[MPD]A:201 |
3 |
1 |
273 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
6361 |
31.4 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.073 |
| Average: |
31.6 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.073 |
| 14 |
21 |
|
[MG]B:201 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
6499 |
27.1 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 15 |
22 |
|
C |
3 |
1 |
6345 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
6499 |
11.7 |
0.1 |
0.675 |
0 |
0 |
0 |
0.000 |
23 |
|
D |
1 |
1 |
6454 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
6361 |
1.8 |
-0.0 |
0.576 |
0 |
0 |
0 |
0.000 |
| Average: |
6.8 |
0.0 |
0.626 |
0 |
0 |
0 |
0.000 |
| 16 |
24 |
|
[MPD]D:201 |
3 |
1 |
273 |
◊ |
[MPD]A:201 |
x,y,z |
1_555 |
3 |
1 |
273 |
11.1 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.011 |
| 17 |
25 |
|
[MPD]A:201 |
2 |
1 |
273 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
6454 |
9.8 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.007 |
26 |
|
[MPD]D:201 |
2 |
1 |
273 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
6499 |
8.2 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.007 |
| Average: |
9.0 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.007 |
|