| ## |
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 |
94 |
25 |
5807 |
◊ |
C |
x,y,z |
1_555 |
99 |
28 |
5833 |
910.9 |
-9.5 |
0.283 |
12 |
2 |
0 |
0.453 |
2 |
|
F |
96 |
25 |
5863 |
◊ |
E |
x,y,z |
1_555 |
103 |
28 |
5757 |
899.9 |
-12.3 |
0.183 |
9 |
1 |
0 |
0.453 |
3 |
|
C |
88 |
24 |
5833 |
◊ |
B |
x,y,z |
1_555 |
98 |
29 |
5836 |
898.7 |
-10.3 |
0.231 |
14 |
2 |
0 |
0.453 |
4 |
|
G |
102 |
28 |
5790 |
◊ |
A |
x,y,z |
1_555 |
96 |
25 |
5811 |
894.1 |
-9.9 |
0.253 |
13 |
1 |
0 |
0.453 |
5 |
|
B |
90 |
25 |
5836 |
◊ |
A |
x,y,z |
1_555 |
96 |
28 |
5811 |
893.2 |
-11.5 |
0.192 |
10 |
1 |
0 |
0.453 |
6 |
|
G |
93 |
25 |
5790 |
◊ |
F |
x,y,z |
1_555 |
97 |
28 |
5863 |
882.5 |
-10.0 |
0.244 |
11 |
2 |
0 |
0.453 |
7 |
|
E |
93 |
26 |
5757 |
◊ |
D |
x,y,z |
1_555 |
103 |
28 |
5807 |
880.0 |
-10.4 |
0.252 |
13 |
1 |
0 |
0.453 |
| Average: |
894.2 |
-10.6 |
0.234 |
12 |
1 |
0 |
0.453 |
| 2 |
8 |
|
D |
42 |
14 |
5807 |
◊ |
A |
-y+1,-x+1,-z |
8_665 |
43 |
15 |
5811 |
375.9 |
-0.1 |
0.723 |
3 |
1 |
0 |
0.083 |
9 |
|
C |
44 |
14 |
5833 |
◊ |
B |
-y+1,-x+1,-z |
8_665 |
42 |
13 |
5836 |
369.0 |
-0.8 |
0.706 |
3 |
0 |
0 |
0.083 |
10 |
|
F |
41 |
13 |
5863 |
◊ |
F |
-y+1,-x+1,-z |
8_665 |
41 |
14 |
5863 |
352.1 |
-2.1 |
0.566 |
2 |
0 |
0 |
0.083 |
11 |
|
G |
39 |
13 |
5790 |
◊ |
E |
-y+1,-x+1,-z |
8_665 |
43 |
14 |
5757 |
348.9 |
-2.3 |
0.530 |
2 |
0 |
0 |
0.083 |
| Average: |
361.5 |
-1.3 |
0.631 |
3 |
0 |
0 |
0.083 |
| 3 |
12 |
|
A |
40 |
13 |
5811 |
◊ |
A |
-x,-y+1,z |
2_565 |
40 |
13 |
5811 |
366.7 |
2.5 |
0.884 |
8 |
10 |
0 |
0.000 |
| 4 |
13 |
|
G |
34 |
9 |
5790 |
◊ |
D |
-y+1/2,x+1/2,z+1/2 |
3_555 |
26 |
8 |
5807 |
240.4 |
1.2 |
0.719 |
2 |
0 |
0 |
0.000 |
| 5 |
14 |
|
C |
25 |
8 |
5833 |
◊ |
A |
-y+1,-x+1,-z |
8_665 |
25 |
7 |
5811 |
215.0 |
-0.8 |
0.625 |
0 |
0 |
0 |
0.011 |
15 |
|
G |
20 |
7 |
5790 |
◊ |
D |
-y+1,-x+1,-z |
8_665 |
23 |
7 |
5807 |
212.7 |
-1.6 |
0.483 |
0 |
0 |
0 |
0.011 |
16 |
|
B |
21 |
6 |
5836 |
◊ |
B |
-y+1,-x+1,-z |
8_665 |
21 |
6 |
5836 |
201.8 |
-1.4 |
0.535 |
0 |
0 |
0 |
0.011 |
17 |
|
F |
17 |
6 |
5863 |
◊ |
E |
-y+1,-x+1,-z |
8_665 |
21 |
6 |
5757 |
174.5 |
-0.3 |
0.659 |
0 |
0 |
0 |
0.011 |
| Average: |
201.0 |
-1.0 |
0.575 |
0 |
0 |
0 |
0.011 |
| 6 |
18 |
|
C |
11 |
4 |
5833 |
◊ |
E |
-x+1/2,y-1/2,-z-1/2 |
5_544 |
14 |
4 |
5757 |
116.1 |
1.4 |
0.673 |
1 |
4 |
0 |
0.000 |
| 7 |
19 |
|
B |
8 |
2 |
5836 |
◊ |
A |
-x,-y+1,z |
2_565 |
14 |
4 |
5811 |
105.8 |
0.6 |
0.749 |
0 |
0 |
0 |
0.000 |
| 8 |
20 |
|
F |
7 |
2 |
5863 |
◊ |
A |
-y+1/2,x+1/2,z-1/2 |
3_554 |
14 |
5 |
5811 |
84.3 |
0.4 |
0.685 |
0 |
0 |
0 |
0.000 |
| 9 |
21 |
|
C |
8 |
3 |
5833 |
◊ |
A |
x,y,z |
1_555 |
12 |
3 |
5811 |
83.5 |
-0.9 |
0.469 |
1 |
0 |
0 |
0.027 |
22 |
|
G |
9 |
3 |
5790 |
◊ |
E |
x,y,z |
1_555 |
12 |
4 |
5757 |
78.9 |
-0.5 |
0.563 |
0 |
0 |
0 |
0.027 |
23 |
|
G |
12 |
3 |
5790 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
5836 |
78.2 |
-1.1 |
0.439 |
0 |
0 |
0 |
0.027 |
24 |
|
F |
8 |
3 |
5863 |
◊ |
D |
x,y,z |
1_555 |
11 |
3 |
5807 |
76.4 |
-0.6 |
0.515 |
1 |
0 |
0 |
0.027 |
25 |
|
E |
7 |
2 |
5757 |
◊ |
C |
x,y,z |
1_555 |
10 |
3 |
5833 |
71.5 |
-0.7 |
0.484 |
0 |
0 |
0 |
0.027 |
26 |
|
D |
7 |
3 |
5807 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
5836 |
69.0 |
-0.9 |
0.442 |
0 |
0 |
0 |
0.027 |
27 |
|
F |
9 |
3 |
5863 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
5811 |
61.3 |
-1.0 |
0.349 |
0 |
0 |
0 |
0.027 |
| Average: |
74.1 |
-0.8 |
0.466 |
0 |
0 |
0 |
0.027 |
| 10 |
28 |
|
F |
7 |
2 |
5863 |
◊ |
D |
x-1/2,-y+3/2,-z-1/2 |
6_464 |
10 |
4 |
5807 |
73.6 |
1.6 |
0.755 |
1 |
1 |
0 |
0.000 |
| 11 |
29 |
|
E |
4 |
1 |
5757 |
◊ |
B |
-y+1/2,x+1/2,z-1/2 |
3_554 |
9 |
4 |
5836 |
66.5 |
1.4 |
0.816 |
1 |
0 |
0 |
0.000 |
| 12 |
30 |
|
B |
3 |
1 |
5836 |
◊ |
B |
y,x,-z |
7_555 |
3 |
1 |
5836 |
35.8 |
-1.1 |
0.181 |
0 |
0 |
0 |
0.000 |
| 13 |
31 |
|
[CA]A:100 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
5811 |
34.1 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.312 |
32 |
|
[CA]B:100 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
5836 |
33.8 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.312 |
33 |
|
[CA]E:100 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
3 |
2 |
5757 |
31.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.312 |
34 |
|
[CA]D:98 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
4 |
3 |
5807 |
31.7 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.312 |
35 |
|
[CA]A:101 |
1 |
1 |
85 |
f |
G |
x,y,z |
1_555 |
3 |
2 |
5790 |
31.0 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.312 |
36 |
|
[CA]C:98 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
3 |
2 |
5833 |
31.0 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.312 |
37 |
|
[CA]G:98 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
4 |
2 |
5863 |
28.0 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.312 |
| Average: |
31.6 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.312 |
| 14 |
38 |
|
[CA]E:99 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
8 |
3 |
5757 |
33.4 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.339 |
39 |
|
[CA]F:98 |
1 |
1 |
85 |
◊ |
F |
-y+1,-x+1,-z |
8_665 |
8 |
3 |
5863 |
32.6 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.339 |
40 |
|
[CA]E:98 |
1 |
1 |
85 |
◊ |
G |
-y+1,-x+1,-z |
8_665 |
8 |
3 |
5790 |
32.1 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.339 |
41 |
|
[CA]A:99 |
1 |
1 |
85 |
◊ |
D |
-y+1,-x+1,-z |
8_665 |
8 |
2 |
5807 |
31.7 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.339 |
42 |
|
[CA]B:99 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
5836 |
31.5 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.339 |
43 |
|
[CA]B:98 |
1 |
1 |
85 |
◊ |
C |
-y+1,-x+1,-z |
8_665 |
4 |
2 |
5833 |
30.6 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.339 |
44 |
|
[CA]A:98 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
5811 |
30.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.339 |
| Average: |
31.7 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.339 |
| 15 |
45 |
|
[CA]A:98 |
1 |
1 |
85 |
f |
D |
-y+1,-x+1,-z |
8_665 |
7 |
4 |
5807 |
32.8 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.322 |
46 |
|
[CA]E:99 |
1 |
1 |
85 |
f |
G |
-y+1,-x+1,-z |
8_665 |
7 |
4 |
5790 |
31.6 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.322 |
47 |
|
[CA]F:98 |
1 |
1 |
85 |
f |
F |
x,y,z |
1_555 |
8 |
4 |
5863 |
31.2 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.322 |
48 |
|
[CA]E:98 |
1 |
1 |
85 |
f |
E |
x,y,z |
1_555 |
8 |
4 |
5757 |
30.1 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.322 |
49 |
|
[CA]B:99 |
1 |
1 |
85 |
f |
C |
-y+1,-x+1,-z |
8_665 |
7 |
4 |
5833 |
29.7 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.322 |
50 |
|
[CA]B:98 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
5836 |
29.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.322 |
51 |
|
[CA]A:99 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
5811 |
29.0 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.322 |
| Average: |
30.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.322 |
| 16 |
52 |
|
[CA]G:98 |
1 |
1 |
85 |
◊ |
G |
x,y,z |
1_555 |
5 |
2 |
5790 |
31.3 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.128 |
53 |
|
[CA]E:100 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
5 |
3 |
5863 |
28.8 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.128 |
54 |
|
[CA]C:98 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
5 |
4 |
5807 |
28.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.128 |
55 |
|
[CA]D:98 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
3 |
3 |
5757 |
26.7 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.128 |
56 |
|
[CA]B:100 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
5833 |
25.4 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.128 |
57 |
|
[CA]A:100 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
5836 |
24.8 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.128 |
58 |
|
[CA]A:101 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
5811 |
24.3 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.128 |
| Average: |
27.1 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.128 |
| 17 |
59 |
|
G |
3 |
2 |
5790 |
◊ |
A |
-x,-y+1,z |
2_565 |
6 |
2 |
5811 |
23.4 |
0.9 |
0.845 |
0 |
0 |
0 |
0.000 |
| 18 |
60 |
|
[CA]B:100 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
5811 |
15.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.054 |
61 |
|
[CA]C:98 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
5836 |
14.3 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.054 |
62 |
|
[CA]E:100 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
5807 |
11.9 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.054 |
63 |
|
[CA]A:100 |
1 |
1 |
85 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
5790 |
11.0 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.054 |
64 |
|
[CA]G:98 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
5757 |
7.6 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.054 |
65 |
|
[CA]D:98 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
5833 |
6.5 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.054 |
66 |
|
[CA]A:101 |
1 |
1 |
85 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
5863 |
5.6 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.054 |
| Average: |
10.3 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.054 |
| 19 |
67 |
|
[CA]A:99 |
1 |
1 |
85 |
◊ |
G |
x,y,z |
1_555 |
3 |
2 |
5790 |
10.2 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.022 |
68 |
|
[CA]B:98 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
5811 |
6.2 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.022 |
69 |
|
[CA]E:98 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
3 |
2 |
5807 |
5.4 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.022 |
70 |
|
[CA]B:99 |
1 |
1 |
85 |
◊ |
B |
-y+1,-x+1,-z |
8_665 |
2 |
2 |
5836 |
4.9 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.022 |
71 |
|
[CA]F:98 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
2 |
2 |
5757 |
3.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.022 |
72 |
|
[CA]A:98 |
1 |
1 |
85 |
◊ |
C |
-y+1,-x+1,-z |
8_665 |
2 |
2 |
5833 |
1.7 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.022 |
73 |
|
[CA]E:99 |
1 |
1 |
85 |
◊ |
F |
-y+1,-x+1,-z |
8_665 |
1 |
1 |
5863 |
1.5 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.022 |
| Average: |
4.8 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.022 |
| 20 |
74 |
|
E |
5 |
4 |
5757 |
◊ |
A |
-y+1/2,x+1/2,z-1/2 |
3_554 |
2 |
1 |
5811 |
7.4 |
0.2 |
0.724 |
0 |
0 |
0 |
0.000 |
| 21 |
75 |
|
G |
2 |
2 |
5790 |
◊ |
B |
-x,-y+1,z |
2_565 |
1 |
1 |
5836 |
5.1 |
0.1 |
0.675 |
0 |
0 |
0 |
0.000 |
| 22 |
76 |
|
D |
1 |
1 |
5807 |
◊ |
B |
-y+1,-x+1,-z |
8_665 |
1 |
1 |
5836 |
1.1 |
0.0 |
0.597 |
0 |
0 |
0 |
0.000 |
|