| ## |
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 |
|
D |
110 |
29 |
9839 |
◊ |
C |
-x,y,-z+1 |
2_556 |
111 |
28 |
9533 |
1085.3 |
-2.6 |
0.499 |
14 |
9 |
0 |
0.483 |
2 |
|
B |
111 |
30 |
9464 |
◊ |
A |
-x,y,-z+1 |
2_556 |
111 |
30 |
9605 |
1078.0 |
-2.5 |
0.495 |
15 |
8 |
0 |
0.483 |
3 |
|
F |
113 |
30 |
9875 |
◊ |
E |
-x,y,-z+1 |
2_556 |
114 |
31 |
9593 |
1063.6 |
-3.2 |
0.469 |
15 |
10 |
0 |
0.483 |
| Average: |
1075.6 |
-2.8 |
0.488 |
15 |
9 |
0 |
0.483 |
| 2 |
4 |
|
D |
85 |
22 |
9839 |
◊ |
C |
x,y,z |
1_555 |
72 |
23 |
9533 |
730.2 |
-2.5 |
0.410 |
11 |
7 |
0 |
0.321 |
5 |
|
C |
78 |
20 |
9533 |
◊ |
B |
x,y,z |
1_555 |
67 |
23 |
9464 |
700.5 |
-1.7 |
0.509 |
10 |
8 |
0 |
0.321 |
6 |
|
D |
63 |
21 |
9839 |
◊ |
A |
x,y,z |
1_555 |
81 |
22 |
9605 |
673.8 |
-3.1 |
0.318 |
7 |
5 |
0 |
0.321 |
7 |
|
F |
63 |
22 |
9875 |
◊ |
B |
x,y,z |
1_555 |
76 |
20 |
9464 |
673.0 |
-3.5 |
0.283 |
9 |
3 |
0 |
0.321 |
8 |
|
E |
78 |
20 |
9593 |
◊ |
A |
x,y,z |
1_555 |
58 |
21 |
9605 |
650.3 |
-3.5 |
0.341 |
8 |
4 |
0 |
0.321 |
| Average: |
685.6 |
-2.9 |
0.372 |
9 |
5 |
0 |
0.321 |
| 3 |
9 |
|
E |
63 |
22 |
9593 |
◊ |
D |
-x-1/2,y-1/2,-z |
4_445 |
62 |
15 |
9839 |
590.3 |
-0.5 |
0.543 |
9 |
6 |
0 |
0.000 |
10 |
|
F |
54 |
13 |
9875 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
56 |
18 |
9533 |
507.7 |
-1.0 |
0.389 |
6 |
3 |
0 |
0.000 |
| Average: |
549.0 |
-0.7 |
0.466 |
8 |
5 |
0 |
0.000 |
| 4 |
11 |
|
F |
40 |
12 |
9875 |
◊ |
E |
x,y,z |
1_555 |
37 |
11 |
9593 |
361.8 |
0.8 |
0.631 |
5 |
6 |
0 |
0.019 |
| 5 |
12 |
|
C |
30 |
8 |
9533 |
◊ |
C |
-x,y,-z+1 |
2_556 |
29 |
8 |
9533 |
283.2 |
-2.0 |
0.327 |
2 |
0 |
0 |
0.077 |
13 |
|
F |
35 |
9 |
9875 |
◊ |
A |
-x,y,-z+1 |
2_556 |
31 |
8 |
9605 |
272.6 |
-2.0 |
0.311 |
4 |
0 |
0 |
0.077 |
14 |
|
D |
31 |
9 |
9839 |
◊ |
B |
-x,y,-z+1 |
2_556 |
28 |
8 |
9464 |
267.8 |
-2.2 |
0.278 |
4 |
0 |
0 |
0.077 |
| Average: |
274.5 |
-2.1 |
0.305 |
3 |
0 |
0 |
0.077 |
| 6 |
15 |
|
F |
11 |
4 |
9875 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
14 |
5 |
9464 |
81.6 |
1.0 |
0.754 |
1 |
0 |
0 |
0.000 |
| 7 |
16 |
|
[MOH]A:203 |
2 |
1 |
140 |
f |
A |
x,y,z |
1_555 |
15 |
9 |
9605 |
79.7 |
-0.5 |
0.633 |
1 |
0 |
0 |
0.031 |
| 8 |
17 |
|
A |
8 |
4 |
9605 |
◊ |
D |
-x-1/2,y-1/2,-z |
4_445 |
7 |
3 |
9839 |
52.4 |
-0.1 |
0.405 |
0 |
0 |
0 |
0.000 |
| 9 |
18 |
|
E |
11 |
4 |
9593 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
7 |
3 |
9605 |
40.2 |
1.1 |
0.780 |
0 |
1 |
0 |
0.000 |
| 10 |
19 |
|
[CA]B:201 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
9 |
3 |
9533 |
37.2 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.401 |
20 |
|
[CA]A:202 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
9605 |
35.2 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.401 |
21 |
|
[CA]D:202 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
9839 |
34.1 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.401 |
| Average: |
35.5 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.401 |
| 11 |
22 |
|
[CA]D:201 |
1 |
1 |
85 |
◊ |
C |
-x,y,-z+1 |
2_556 |
6 |
2 |
9533 |
33.5 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.517 |
23 |
|
[CA]E:201 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
6 |
2 |
9593 |
32.5 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.517 |
24 |
|
[CA]E:201 |
1 |
1 |
85 |
◊ |
F |
-x,y,-z+1 |
2_556 |
6 |
2 |
9875 |
31.1 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.517 |
25 |
|
[CA]A:201 |
1 |
1 |
85 |
◊ |
B |
-x,y,-z+1 |
2_556 |
6 |
2 |
9464 |
30.5 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.517 |
26 |
|
[CA]A:201 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
9605 |
30.4 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.517 |
27 |
|
[CA]D:201 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
9839 |
28.8 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.517 |
| Average: |
31.2 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.517 |
| 12 |
28 |
|
[CA]A:202 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
9 |
4 |
9839 |
32.9 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.123 |
29 |
|
[CA]D:202 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
9533 |
32.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.123 |
30 |
|
[CA]B:201 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
9464 |
29.5 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.123 |
| Average: |
31.5 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.123 |
| 13 |
31 |
|
B |
2 |
2 |
9464 |
◊ |
C |
-x+1/2,y-1/2,-z+1 |
4_546 |
2 |
1 |
9533 |
6.3 |
-0.1 |
0.492 |
0 |
0 |
0 |
0.000 |
| 14 |
32 |
|
D |
1 |
1 |
9839 |
◊ |
C |
-x,y,-z |
2_555 |
1 |
1 |
9533 |
1.4 |
0.0 |
0.592 |
0 |
0 |
0 |
0.000 |
|