| ## |
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 |
233 |
67 |
15011 |
◊ |
C |
x,y,z |
1_555 |
238 |
67 |
14850 |
2334.6 |
-31.3 |
0.018 |
27 |
2 |
0 |
0.925 |
2 |
|
B |
236 |
66 |
14803 |
◊ |
A |
x,y,z |
1_555 |
228 |
66 |
15157 |
2328.0 |
-30.8 |
0.022 |
23 |
2 |
0 |
0.925 |
3 |
|
F |
238 |
67 |
14866 |
◊ |
E |
x,y,z |
1_555 |
244 |
68 |
14986 |
2325.2 |
-32.0 |
0.026 |
21 |
1 |
0 |
0.925 |
4 |
|
H |
235 |
68 |
15107 |
◊ |
G |
x,y,z |
1_555 |
235 |
66 |
14767 |
2311.1 |
-31.4 |
0.021 |
25 |
2 |
0 |
0.925 |
| Average: |
2324.7 |
-31.4 |
0.022 |
24 |
2 |
0 |
0.925 |
| 2 |
5 |
|
D |
110 |
33 |
15011 |
◊ |
B |
x,y,z |
1_555 |
113 |
33 |
14803 |
1217.5 |
-0.6 |
0.671 |
19 |
5 |
0 |
0.157 |
6 |
|
H |
118 |
33 |
15107 |
◊ |
F |
x,y,z |
1_555 |
118 |
33 |
14866 |
1185.7 |
-1.0 |
0.666 |
18 |
6 |
0 |
0.157 |
7 |
|
C |
113 |
34 |
14850 |
◊ |
A |
x,y,z |
1_555 |
102 |
32 |
15157 |
1134.1 |
-3.0 |
0.537 |
17 |
5 |
0 |
0.157 |
8 |
|
G |
104 |
32 |
14767 |
◊ |
E |
x,y,z |
1_555 |
107 |
32 |
14986 |
1105.8 |
-3.2 |
0.545 |
14 |
4 |
0 |
0.157 |
| Average: |
1160.8 |
-2.0 |
0.605 |
17 |
5 |
0 |
0.157 |
| 3 |
9 |
|
E |
62 |
15 |
14986 |
◊ |
G |
x-1,y,z |
1_455 |
54 |
15 |
14767 |
544.1 |
-1.0 |
0.661 |
5 |
8 |
0 |
0.000 |
| 4 |
10 |
|
A |
58 |
17 |
15157 |
◊ |
F |
-x,y-1/2,-z |
2_545 |
52 |
17 |
14866 |
494.0 |
1.1 |
0.771 |
5 |
6 |
0 |
0.000 |
11 |
|
B |
46 |
15 |
14803 |
◊ |
E |
-x,y-1/2,-z+1 |
2_546 |
55 |
18 |
14986 |
465.9 |
1.9 |
0.797 |
3 |
5 |
0 |
0.000 |
| Average: |
480.0 |
1.5 |
0.784 |
4 |
6 |
0 |
0.000 |
| 5 |
12 |
|
D |
52 |
17 |
15011 |
◊ |
G |
x-1,y,z |
1_455 |
46 |
13 |
14767 |
482.9 |
2.0 |
0.736 |
4 |
3 |
0 |
0.000 |
| 6 |
13 |
|
A |
59 |
17 |
15157 |
◊ |
C |
x-1,y,z |
1_455 |
49 |
15 |
14850 |
472.9 |
2.4 |
0.832 |
6 |
9 |
0 |
0.000 |
| 7 |
14 |
|
D |
41 |
15 |
15011 |
◊ |
A |
x,y,z |
1_555 |
43 |
16 |
15157 |
420.0 |
-6.2 |
0.125 |
4 |
0 |
0 |
0.130 |
15 |
|
H |
39 |
14 |
15107 |
◊ |
E |
x,y,z |
1_555 |
40 |
15 |
14986 |
418.9 |
-6.7 |
0.104 |
4 |
0 |
0 |
0.130 |
16 |
|
G |
41 |
15 |
14767 |
◊ |
F |
x,y,z |
1_555 |
42 |
15 |
14866 |
413.7 |
-7.1 |
0.087 |
4 |
0 |
0 |
0.130 |
17 |
|
C |
41 |
15 |
14850 |
◊ |
B |
x,y,z |
1_555 |
44 |
15 |
14803 |
411.6 |
-7.0 |
0.101 |
4 |
0 |
0 |
0.130 |
| Average: |
416.0 |
-6.8 |
0.104 |
4 |
0 |
0 |
0.130 |
| 8 |
18 |
|
H |
34 |
10 |
15107 |
◊ |
D |
x,y,z-1 |
1_554 |
47 |
16 |
15011 |
356.1 |
-1.4 |
0.551 |
2 |
3 |
0 |
0.000 |
| 9 |
19 |
|
[RO3]A:1336 |
20 |
1 |
497 |
f |
A |
x,y,z |
1_555 |
45 |
17 |
15157 |
299.0 |
1.0 |
0.288 |
6 |
0 |
0 |
0.100 |
20 |
|
[RO3]B:1336 |
20 |
1 |
492 |
f |
B |
x,y,z |
1_555 |
50 |
17 |
14803 |
292.9 |
0.5 |
0.258 |
6 |
0 |
0 |
0.100 |
21 |
|
[RO3]H:1336 |
20 |
1 |
495 |
f |
H |
x,y,z |
1_555 |
48 |
17 |
15107 |
289.3 |
0.7 |
0.283 |
6 |
0 |
0 |
0.100 |
22 |
|
[RO3]D:1336 |
20 |
1 |
495 |
f |
D |
x,y,z |
1_555 |
46 |
17 |
15011 |
289.2 |
0.6 |
0.246 |
6 |
0 |
0 |
0.100 |
23 |
|
[RO3]C:1336 |
20 |
1 |
498 |
f |
C |
x,y,z |
1_555 |
49 |
18 |
14850 |
287.3 |
1.1 |
0.301 |
6 |
0 |
0 |
0.100 |
24 |
|
[RO3]F:1336 |
20 |
1 |
497 |
f |
F |
x,y,z |
1_555 |
46 |
18 |
14866 |
286.8 |
0.7 |
0.252 |
6 |
0 |
0 |
0.100 |
25 |
|
[RO3]E:1336 |
20 |
1 |
493 |
f |
E |
x,y,z |
1_555 |
44 |
17 |
14986 |
284.7 |
1.3 |
0.314 |
6 |
0 |
0 |
0.100 |
26 |
|
[RO3]G:1336 |
20 |
1 |
494 |
f |
G |
x,y,z |
1_555 |
47 |
19 |
14767 |
279.4 |
1.1 |
0.286 |
6 |
0 |
0 |
0.100 |
| Average: |
288.6 |
0.9 |
0.279 |
6 |
0 |
0 |
0.100 |
| 10 |
27 |
|
F |
23 |
6 |
14866 |
◊ |
E |
x,y,z-1 |
1_554 |
24 |
7 |
14986 |
193.6 |
-1.6 |
0.476 |
4 |
0 |
0 |
0.000 |
28 |
|
A |
22 |
6 |
15157 |
◊ |
B |
x,y,z-1 |
1_554 |
25 |
6 |
14803 |
186.0 |
-0.6 |
0.575 |
5 |
0 |
0 |
0.000 |
| Average: |
189.8 |
-1.1 |
0.526 |
5 |
0 |
0 |
0.000 |
| 11 |
29 |
|
D |
17 |
7 |
15011 |
x |
D |
x-1,y,z |
1_455 |
16 |
4 |
15011 |
163.0 |
-0.8 |
0.519 |
1 |
0 |
0 |
0.000 |
| 12 |
30 |
|
G |
10 |
4 |
14767 |
◊ |
C |
x,y,z |
1_555 |
11 |
5 |
14850 |
94.4 |
0.7 |
0.647 |
1 |
0 |
0 |
0.000 |
| 13 |
31 |
|
[RO3]G:1336 |
5 |
1 |
494 |
◊ |
E |
x,y,z |
1_555 |
14 |
6 |
14986 |
76.0 |
-0.8 |
0.240 |
0 |
0 |
0 |
0.022 |
32 |
|
[RO3]C:1336 |
5 |
1 |
498 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
15157 |
73.8 |
-0.5 |
0.290 |
0 |
0 |
0 |
0.022 |
33 |
|
[RO3]F:1336 |
5 |
1 |
497 |
◊ |
H |
x,y,z |
1_555 |
13 |
6 |
15107 |
73.7 |
-0.7 |
0.245 |
0 |
0 |
0 |
0.022 |
34 |
|
[RO3]D:1336 |
3 |
1 |
495 |
◊ |
B |
x,y,z |
1_555 |
13 |
6 |
14803 |
69.2 |
-0.7 |
0.264 |
0 |
0 |
0 |
0.022 |
35 |
|
[RO3]B:1336 |
4 |
1 |
492 |
◊ |
D |
x,y,z |
1_555 |
12 |
6 |
15011 |
68.8 |
-0.8 |
0.246 |
0 |
0 |
0 |
0.022 |
36 |
|
[RO3]E:1336 |
3 |
1 |
493 |
◊ |
G |
x,y,z |
1_555 |
15 |
6 |
14767 |
68.6 |
-0.5 |
0.302 |
0 |
0 |
0 |
0.022 |
37 |
|
[RO3]H:1336 |
4 |
1 |
495 |
◊ |
F |
x,y,z |
1_555 |
13 |
6 |
14866 |
67.2 |
-0.8 |
0.257 |
0 |
0 |
0 |
0.022 |
38 |
|
[RO3]A:1336 |
3 |
1 |
497 |
◊ |
C |
x,y,z |
1_555 |
15 |
6 |
14850 |
63.8 |
-0.6 |
0.295 |
0 |
0 |
0 |
0.022 |
| Average: |
70.1 |
-0.7 |
0.267 |
0 |
0 |
0 |
0.022 |
| 14 |
39 |
|
[RO3]H:1336 |
9 |
1 |
495 |
◊ |
[RO3]F:1336 |
x,y,z |
1_555 |
9 |
1 |
497 |
64.5 |
-0.9 |
0.090 |
0 |
0 |
0 |
0.015 |
40 |
|
[RO3]D:1336 |
9 |
1 |
495 |
◊ |
[RO3]B:1336 |
x,y,z |
1_555 |
9 |
1 |
492 |
63.0 |
-0.9 |
0.085 |
0 |
0 |
0 |
0.015 |
41 |
|
[RO3]G:1336 |
9 |
1 |
494 |
◊ |
[RO3]E:1336 |
x,y,z |
1_555 |
10 |
1 |
493 |
62.7 |
-1.0 |
0.079 |
0 |
0 |
0 |
0.015 |
42 |
|
[RO3]C:1336 |
10 |
1 |
498 |
◊ |
[RO3]A:1336 |
x,y,z |
1_555 |
8 |
1 |
497 |
59.4 |
-1.2 |
0.080 |
0 |
0 |
0 |
0.015 |
| Average: |
62.4 |
-1.0 |
0.083 |
0 |
0 |
0 |
0.015 |
| 15 |
43 |
|
H |
5 |
4 |
15107 |
◊ |
C |
x,y,z |
1_555 |
11 |
4 |
14850 |
49.8 |
0.5 |
0.684 |
0 |
0 |
0 |
0.000 |
| 16 |
44 |
|
B |
8 |
4 |
14803 |
◊ |
C |
x-1,y,z |
1_455 |
7 |
4 |
14850 |
47.8 |
0.5 |
0.605 |
0 |
0 |
0 |
0.000 |
| 17 |
45 |
|
C |
3 |
1 |
14850 |
◊ |
G |
x-1,y,z |
1_455 |
1 |
1 |
14767 |
21.3 |
-0.2 |
0.278 |
0 |
0 |
0 |
0.000 |
| 18 |
46 |
|
A |
2 |
1 |
15157 |
◊ |
E |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
14986 |
11.1 |
-0.1 |
0.393 |
0 |
0 |
0 |
0.000 |
| 19 |
47 |
|
E |
2 |
1 |
14986 |
◊ |
H |
x-1,y,z |
1_455 |
2 |
1 |
15107 |
11.1 |
0.1 |
0.704 |
0 |
0 |
0 |
0.000 |
| 20 |
48 |
|
D |
1 |
1 |
15011 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
14850 |
1.5 |
0.1 |
0.759 |
0 |
0 |
0 |
0.000 |
|