| ## |
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 |
286 |
72 |
13890 |
◊ |
C |
x,y,z |
1_555 |
287 |
72 |
13926 |
2791.5 |
-40.2 |
0.012 |
40 |
25 |
0 |
0.719 |
2 |
|
B |
285 |
72 |
13945 |
◊ |
A |
x,y,z |
1_555 |
279 |
69 |
13853 |
2780.0 |
-39.9 |
0.012 |
38 |
26 |
0 |
0.719 |
| Average: |
2785.8 |
-40.1 |
0.012 |
39 |
26 |
0 |
0.719 |
| 2 |
3 |
|
H |
112 |
23 |
5382 |
◊ |
G |
x,y,z |
1_555 |
112 |
23 |
5371 |
1060.4 |
-4.6 |
0.853 |
49 |
0 |
0 |
1.000 |
4 |
|
F |
110 |
23 |
5376 |
◊ |
E |
x,y,z |
1_555 |
111 |
23 |
5355 |
1046.6 |
-5.8 |
0.834 |
49 |
0 |
0 |
1.000 |
| Average: |
1053.5 |
-5.2 |
0.844 |
49 |
0 |
0 |
1.000 |
| 3 |
5 |
|
H |
51 |
8 |
5382 |
◊ |
D |
x,y,z |
1_555 |
64 |
20 |
13890 |
513.1 |
-8.4 |
0.424 |
10 |
0 |
0 |
0.579 |
6 |
|
F |
51 |
8 |
5376 |
◊ |
B |
x,y,z |
1_555 |
62 |
19 |
13945 |
502.2 |
-7.9 |
0.448 |
9 |
0 |
0 |
0.579 |
7 |
|
G |
53 |
8 |
5371 |
◊ |
C |
x,y,z |
1_555 |
59 |
19 |
13926 |
500.2 |
-8.0 |
0.447 |
8 |
0 |
0 |
0.579 |
8 |
|
E |
50 |
8 |
5355 |
◊ |
A |
x,y,z |
1_555 |
61 |
20 |
13853 |
494.2 |
-7.5 |
0.455 |
8 |
0 |
0 |
0.579 |
| Average: |
502.4 |
-7.9 |
0.443 |
9 |
0 |
0 |
0.579 |
| 4 |
9 |
|
[NAJ]B:900 |
40 |
1 |
823 |
f |
B |
x,y,z |
1_555 |
62 |
22 |
13945 |
486.2 |
-6.6 |
0.387 |
5 |
0 |
0 |
0.446 |
10 |
|
[NAJ]A:900 |
40 |
1 |
822 |
f |
A |
x,y,z |
1_555 |
65 |
22 |
13853 |
483.8 |
-6.7 |
0.391 |
7 |
0 |
0 |
0.446 |
11 |
|
[NAJ]C:900 |
41 |
1 |
810 |
f |
C |
x,y,z |
1_555 |
61 |
22 |
13926 |
480.4 |
-6.6 |
0.395 |
6 |
0 |
0 |
0.446 |
12 |
|
[NAJ]D:900 |
41 |
1 |
817 |
f |
D |
x,y,z |
1_555 |
65 |
22 |
13890 |
480.4 |
-6.7 |
0.399 |
6 |
0 |
0 |
0.446 |
| Average: |
482.7 |
-6.6 |
0.393 |
6 |
0 |
0 |
0.446 |
| 5 |
13 |
|
E |
52 |
9 |
5355 |
◊ |
B |
x,y,z |
1_555 |
45 |
14 |
13945 |
449.8 |
-5.6 |
0.536 |
6 |
0 |
0 |
0.103 |
14 |
|
G |
51 |
9 |
5371 |
◊ |
D |
x,y,z |
1_555 |
44 |
15 |
13890 |
446.9 |
-5.0 |
0.556 |
6 |
0 |
0 |
0.103 |
15 |
|
F |
51 |
9 |
5376 |
◊ |
A |
x,y,z |
1_555 |
44 |
14 |
13853 |
446.3 |
-4.6 |
0.584 |
6 |
0 |
0 |
0.103 |
16 |
|
H |
50 |
9 |
5382 |
◊ |
C |
x,y,z |
1_555 |
43 |
14 |
13926 |
440.4 |
-4.9 |
0.562 |
6 |
0 |
0 |
0.103 |
| Average: |
445.8 |
-5.0 |
0.559 |
6 |
0 |
0 |
0.103 |
| 6 |
17 |
|
C |
45 |
11 |
13926 |
◊ |
B |
x-1,y,z |
1_455 |
45 |
13 |
13945 |
444.4 |
-1.0 |
0.615 |
4 |
3 |
0 |
0.010 |
| 7 |
18 |
|
C |
32 |
11 |
13926 |
◊ |
A |
x-1/2,-y-1/2,-z |
3_445 |
32 |
8 |
13853 |
306.8 |
-2.9 |
0.337 |
3 |
4 |
0 |
0.033 |
19 |
|
D |
28 |
6 |
13890 |
◊ |
B |
x-1/2,-y-1/2,-z |
3_445 |
29 |
11 |
13945 |
273.3 |
-0.7 |
0.529 |
3 |
1 |
0 |
0.033 |
| Average: |
290.0 |
-1.8 |
0.433 |
3 |
3 |
0 |
0.033 |
| 8 |
20 |
|
D |
38 |
12 |
13890 |
◊ |
A |
x-1/2,-y-1/2,-z |
3_445 |
36 |
12 |
13853 |
283.1 |
0.5 |
0.721 |
5 |
4 |
0 |
0.011 |
| 9 |
21 |
|
D |
30 |
8 |
13890 |
◊ |
A |
x,y,z |
1_555 |
35 |
10 |
13853 |
276.8 |
0.3 |
0.669 |
3 |
3 |
0 |
0.000 |
| 10 |
22 |
|
B |
23 |
5 |
13945 |
◊ |
E |
-x+3/2,-y,z-1/2 |
2_654 |
18 |
2 |
5355 |
163.2 |
-2.3 |
0.419 |
0 |
0 |
0 |
0.011 |
| 11 |
23 |
|
C |
17 |
4 |
13926 |
◊ |
A |
x-1,y,z |
1_455 |
15 |
4 |
13853 |
140.5 |
2.1 |
0.846 |
1 |
0 |
0 |
0.000 |
| 12 |
24 |
|
[NAJ]D:900 |
14 |
1 |
817 |
◊ |
C |
x,y,z |
1_555 |
19 |
5 |
13926 |
130.3 |
-1.9 |
0.456 |
2 |
0 |
0 |
0.066 |
25 |
|
[NAJ]B:900 |
13 |
1 |
823 |
◊ |
A |
x,y,z |
1_555 |
18 |
4 |
13853 |
129.7 |
-2.0 |
0.453 |
2 |
0 |
0 |
0.066 |
26 |
|
[NAJ]C:900 |
13 |
1 |
810 |
◊ |
D |
x,y,z |
1_555 |
20 |
6 |
13890 |
127.8 |
-1.9 |
0.473 |
2 |
0 |
0 |
0.066 |
27 |
|
[NAJ]A:900 |
13 |
1 |
822 |
◊ |
B |
x,y,z |
1_555 |
17 |
4 |
13945 |
126.2 |
-1.9 |
0.450 |
2 |
0 |
0 |
0.066 |
| Average: |
128.5 |
-1.9 |
0.458 |
2 |
0 |
0 |
0.066 |
| 13 |
28 |
|
A |
9 |
3 |
13853 |
◊ |
B |
x-1/2,-y-1/2,-z |
3_445 |
9 |
4 |
13945 |
79.1 |
-0.8 |
0.458 |
0 |
0 |
0 |
0.000 |
| 14 |
29 |
|
H |
11 |
1 |
5382 |
◊ |
F |
x-1/2,-y+1/2,-z |
3_455 |
7 |
2 |
5376 |
55.0 |
0.5 |
0.663 |
0 |
0 |
0 |
0.000 |
| 15 |
30 |
|
C |
4 |
2 |
13926 |
◊ |
H |
-x,y-1/2,-z+1/2 |
4_545 |
12 |
3 |
5382 |
53.1 |
-0.8 |
0.581 |
0 |
0 |
0 |
0.004 |
| 16 |
31 |
|
[NAJ]C:900 |
4 |
1 |
810 |
◊ |
B |
x-1,y,z |
1_455 |
10 |
2 |
13945 |
47.6 |
0.9 |
0.748 |
1 |
0 |
0 |
0.000 |
| 17 |
32 |
|
C |
3 |
2 |
13926 |
◊ |
A |
x-1/2,-y+1/2,-z |
3_455 |
3 |
1 |
13853 |
37.0 |
-0.5 |
0.346 |
0 |
0 |
0 |
0.000 |
| 18 |
33 |
|
C |
2 |
1 |
13926 |
◊ |
[NAJ]A:900 |
x-1/2,-y-1/2,-z |
3_445 |
4 |
1 |
822 |
29.7 |
-0.7 |
0.274 |
0 |
0 |
0 |
0.006 |
34 |
|
[NAJ]D:900 |
3 |
1 |
817 |
◊ |
B |
x-1/2,-y-1/2,-z |
3_445 |
1 |
1 |
13945 |
16.1 |
-0.6 |
0.276 |
0 |
0 |
0 |
0.006 |
| Average: |
22.9 |
-0.6 |
0.275 |
0 |
0 |
0 |
0.006 |
| 19 |
35 |
|
H |
1 |
1 |
5382 |
◊ |
E |
x-1/2,-y+1/2,-z |
3_455 |
3 |
1 |
5355 |
18.8 |
0.6 |
0.566 |
0 |
0 |
0 |
0.000 |
| 20 |
36 |
|
F |
4 |
1 |
5376 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
1 |
13890 |
17.8 |
-0.3 |
0.575 |
0 |
0 |
0 |
0.000 |
| 21 |
37 |
|
C |
5 |
2 |
13926 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
13945 |
17.6 |
0.1 |
0.694 |
0 |
0 |
0 |
0.000 |
| 22 |
38 |
|
C |
2 |
1 |
13926 |
◊ |
G |
-x,y-1/2,-z+1/2 |
4_545 |
3 |
1 |
5371 |
14.3 |
-0.3 |
0.554 |
0 |
0 |
0 |
0.001 |
| 23 |
39 |
|
[NAJ]C:900 |
3 |
1 |
810 |
◊ |
A |
x-1/2,-y-1/2,-z |
3_445 |
4 |
2 |
13853 |
10.3 |
-0.7 |
0.442 |
0 |
0 |
0 |
0.003 |
| 24 |
40 |
|
A |
2 |
1 |
13853 |
◊ |
E |
-x+3/2,-y,z-1/2 |
2_654 |
1 |
1 |
5355 |
9.4 |
0.5 |
0.784 |
0 |
0 |
0 |
0.000 |
| 25 |
41 |
|
B |
2 |
1 |
13945 |
◊ |
F |
-x+3/2,-y,z-1/2 |
2_654 |
1 |
1 |
5376 |
7.4 |
-0.4 |
0.359 |
0 |
0 |
0 |
0.002 |
| 26 |
42 |
|
G |
2 |
1 |
5371 |
◊ |
E |
x-1/2,-y+1/2,-z |
3_455 |
1 |
1 |
5355 |
7.0 |
-0.2 |
0.332 |
0 |
0 |
0 |
0.000 |
| 27 |
43 |
|
A |
1 |
1 |
13853 |
◊ |
G |
-x+3/2,-y,z-1/2 |
2_654 |
2 |
1 |
5371 |
5.1 |
0.0 |
0.553 |
0 |
0 |
0 |
0.000 |
| 28 |
44 |
|
G |
1 |
1 |
5371 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
13945 |
1.4 |
-0.1 |
0.439 |
0 |
0 |
0 |
0.000 |
|