| ## |
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 |
|
F |
378 |
107 |
15743 |
◊ |
A |
x,y,z |
1_555 |
309 |
67 |
31541 |
3377.4 |
-35.1 |
0.034 |
37 |
12 |
0 |
0.747 |
2 |
|
E |
371 |
106 |
15600 |
◊ |
B |
x,y,z |
1_555 |
306 |
68 |
31667 |
3303.1 |
-35.4 |
0.027 |
38 |
9 |
0 |
0.747 |
| Average: |
3340.2 |
-35.2 |
0.030 |
38 |
11 |
0 |
0.747 |
| 2 |
3 |
|
S |
295 |
74 |
9347 |
◊ |
B |
x,y,z |
1_555 |
299 |
80 |
31667 |
2971.0 |
-36.9 |
0.084 |
41 |
17 |
0 |
0.776 |
4 |
|
T |
287 |
73 |
9322 |
◊ |
A |
x,y,z |
1_555 |
307 |
80 |
31541 |
2950.0 |
-36.8 |
0.087 |
40 |
13 |
0 |
0.776 |
| Average: |
2960.5 |
-36.8 |
0.086 |
41 |
15 |
0 |
0.776 |
| 3 |
5 |
|
T |
68 |
17 |
9322 |
◊ |
F |
x,y,z |
1_555 |
66 |
21 |
15743 |
608.8 |
-7.0 |
0.219 |
7 |
2 |
0 |
0.075 |
6 |
|
S |
65 |
16 |
9347 |
◊ |
E |
x,y,z |
1_555 |
63 |
20 |
15600 |
584.1 |
-7.8 |
0.163 |
4 |
1 |
0 |
0.075 |
| Average: |
596.4 |
-7.4 |
0.191 |
6 |
2 |
0 |
0.075 |
| 4 |
7 |
|
A |
67 |
17 |
31541 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
62 |
19 |
31541 |
603.0 |
-5.1 |
0.410 |
7 |
1 |
0 |
0.000 |
| 5 |
8 |
|
B |
56 |
15 |
31667 |
x |
B |
-x+1,y-1/2,-z+2 |
2_647 |
55 |
17 |
31667 |
525.0 |
-5.1 |
0.333 |
6 |
2 |
0 |
0.000 |
| 6 |
9 |
|
[CJD]B:708 |
31 |
1 |
650 |
f |
B |
x,y,z |
1_555 |
69 |
18 |
31667 |
467.5 |
-15.3 |
0.526 |
3 |
0 |
0 |
0.240 |
10 |
|
[CJD]A:708 |
31 |
1 |
652 |
f |
A |
x,y,z |
1_555 |
71 |
18 |
31541 |
466.6 |
-15.8 |
0.529 |
3 |
0 |
0 |
0.240 |
| Average: |
467.1 |
-15.6 |
0.528 |
3 |
0 |
0 |
0.240 |
| 7 |
11 |
|
F |
51 |
19 |
15743 |
◊ |
B |
x,y,z-1 |
1_554 |
39 |
14 |
31667 |
392.9 |
-0.4 |
0.629 |
3 |
0 |
0 |
0.000 |
| 8 |
12 |
|
E |
39 |
15 |
15600 |
◊ |
A |
x,y,z |
1_555 |
32 |
11 |
31541 |
313.5 |
-0.2 |
0.627 |
2 |
0 |
0 |
0.000 |
| 9 |
13 |
|
A |
27 |
12 |
31541 |
◊ |
E |
-x+1,y-1/2,-z+1 |
2_646 |
26 |
8 |
15600 |
235.7 |
-1.3 |
0.308 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
T |
20 |
8 |
9322 |
◊ |
A |
-x+2,y-1/2,-z+1 |
2_746 |
24 |
8 |
31541 |
221.8 |
-1.0 |
0.467 |
0 |
0 |
0 |
0.000 |
| 11 |
15 |
|
S |
23 |
7 |
9347 |
◊ |
B |
-x+2,y-1/2,-z+2 |
2_747 |
22 |
7 |
31667 |
202.0 |
-1.9 |
0.470 |
0 |
0 |
0 |
0.000 |
| 12 |
16 |
|
A |
20 |
8 |
31541 |
◊ |
F |
-x+2,y-1/2,-z+1 |
2_746 |
14 |
4 |
15743 |
155.6 |
0.3 |
0.656 |
1 |
0 |
0 |
0.000 |
| 13 |
17 |
|
B |
21 |
9 |
31667 |
◊ |
E |
-x+2,y-1/2,-z+2 |
2_747 |
13 |
4 |
15600 |
151.2 |
0.3 |
0.664 |
2 |
1 |
0 |
0.000 |
| 14 |
18 |
|
B |
16 |
6 |
31667 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
18 |
5 |
15743 |
145.4 |
0.2 |
0.615 |
1 |
0 |
0 |
0.000 |
| 15 |
19 |
|
B |
19 |
5 |
31667 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
15 |
4 |
31541 |
142.6 |
1.1 |
0.759 |
2 |
4 |
0 |
0.000 |
| 16 |
20 |
|
E |
10 |
5 |
15600 |
◊ |
A |
x-1,y,z |
1_455 |
15 |
6 |
31541 |
128.9 |
0.3 |
0.670 |
1 |
0 |
0 |
0.000 |
| 17 |
21 |
|
B |
11 |
5 |
31667 |
◊ |
A |
x,y,z |
1_555 |
17 |
9 |
31541 |
127.2 |
1.2 |
0.803 |
1 |
0 |
0 |
0.000 |
| 18 |
22 |
|
F |
11 |
6 |
15743 |
◊ |
B |
x-1,y,z-1 |
1_454 |
15 |
6 |
31667 |
123.9 |
0.8 |
0.726 |
0 |
0 |
0 |
0.000 |
| 19 |
23 |
|
A |
12 |
5 |
31541 |
◊ |
B |
x,y,z-1 |
1_554 |
12 |
6 |
31667 |
120.7 |
-0.1 |
0.629 |
1 |
0 |
0 |
0.000 |
| 20 |
24 |
|
A |
13 |
4 |
31541 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
12 |
3 |
31667 |
92.6 |
-0.9 |
0.495 |
1 |
0 |
0 |
0.000 |
| 21 |
25 |
|
S |
11 |
2 |
9347 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
2 |
15743 |
73.9 |
0.6 |
0.586 |
2 |
0 |
0 |
0.000 |
| 22 |
26 |
|
B |
8 |
4 |
31667 |
x |
B |
-x+2,y-1/2,-z+2 |
2_747 |
8 |
3 |
31667 |
63.3 |
-0.5 |
0.507 |
0 |
0 |
0 |
0.000 |
| 23 |
27 |
|
T |
5 |
2 |
9322 |
◊ |
F |
-x+2,y-1/2,-z+1 |
2_746 |
8 |
3 |
15743 |
60.8 |
-0.5 |
0.435 |
0 |
0 |
0 |
0.000 |
| 24 |
28 |
|
[CJD]B:708 |
2 |
1 |
650 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
15600 |
25.1 |
-1.6 |
0.095 |
0 |
0 |
0 |
0.022 |
29 |
|
[CJD]A:708 |
2 |
1 |
652 |
◊ |
F |
x,y,z |
1_555 |
2 |
1 |
15743 |
24.4 |
-0.9 |
0.331 |
0 |
0 |
0 |
0.022 |
| Average: |
24.8 |
-1.2 |
0.213 |
0 |
0 |
0 |
0.022 |
| 25 |
30 |
|
B |
4 |
3 |
31667 |
◊ |
T |
x-1,y,z |
1_455 |
4 |
2 |
9322 |
20.8 |
0.6 |
0.728 |
0 |
0 |
0 |
0.000 |
| 26 |
31 |
|
[ZN]B:703 |
1 |
1 |
98 |
f |
[ZN]B:702 |
x,y,z |
1_555 |
1 |
1 |
98 |
18.6 |
-14.9 |
0.000 |
0 |
0 |
0 |
0.037 |
| 27 |
32 |
|
[ZN]A:705 |
1 |
1 |
98 |
f |
[ZN]A:704 |
x,y,z |
1_555 |
1 |
1 |
98 |
18.1 |
-14.5 |
0.000 |
0 |
0 |
0 |
0.042 |
| 28 |
33 |
|
[ZN]B:703 |
1 |
1 |
98 |
f |
[ZN]B:701 |
x,y,z |
1_555 |
1 |
1 |
98 |
17.7 |
-14.2 |
0.000 |
0 |
0 |
0 |
0.035 |
| 29 |
34 |
|
[ZN]B:706 |
1 |
1 |
98 |
f |
[ZN]B:705 |
x,y,z |
1_555 |
1 |
1 |
98 |
16.0 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.043 |
| 30 |
35 |
|
[ZN]A:702 |
1 |
1 |
98 |
f |
[ZN]A:701 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.4 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.036 |
| 31 |
36 |
|
T |
3 |
2 |
9322 |
◊ |
B |
x,y,z-1 |
1_554 |
1 |
1 |
31667 |
15.1 |
0.0 |
0.614 |
0 |
0 |
0 |
0.000 |
| 32 |
37 |
|
[ZN]A:703 |
1 |
1 |
98 |
f |
[ZN]A:701 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.0 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.035 |
| 33 |
38 |
|
[ZN]B:702 |
1 |
1 |
98 |
f |
[ZN]B:701 |
x,y,z |
1_555 |
1 |
1 |
98 |
14.1 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.028 |
| 34 |
39 |
|
[ZN]A:706 |
1 |
1 |
98 |
f |
[ZN]A:704 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.5 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.032 |
| 35 |
40 |
|
[ZN]A:703 |
1 |
1 |
98 |
f |
[ZN]A:702 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.0 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.030 |
| 36 |
41 |
|
[ZN]A:706 |
1 |
1 |
98 |
f |
[ZN]A:705 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.2 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.026 |
| 37 |
42 |
|
[ZN]B:706 |
1 |
1 |
98 |
f |
[ZN]B:704 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.1 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.030 |
| 38 |
43 |
|
[ZN]B:705 |
1 |
1 |
98 |
f |
[ZN]B:704 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.4 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.028 |
| 39 |
44 |
|
S |
1 |
1 |
9347 |
◊ |
E |
-x+2,y-1/2,-z+2 |
2_747 |
3 |
1 |
15600 |
6.9 |
-0.1 |
0.447 |
0 |
0 |
0 |
0.000 |
|