| ## |
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 |
|
B |
114 |
33 |
16203 |
◊ |
A |
x,y,z |
1_555 |
111 |
31 |
16428 |
1126.3 |
-15.1 |
0.020 |
10 |
3 |
0 |
1.000 |
2 |
|
D |
112 |
26 |
16560 |
◊ |
C |
x,y,z |
1_555 |
108 |
30 |
16494 |
1030.9 |
-11.5 |
0.074 |
9 |
3 |
0 |
1.000 |
| Average: |
1078.6 |
-13.3 |
0.047 |
10 |
3 |
0 |
1.000 |
| 2 |
3 |
|
F |
71 |
14 |
4125 |
◊ |
H |
x,y,z |
1_555 |
69 |
14 |
3331 |
660.3 |
-3.1 |
0.777 |
26 |
0 |
0 |
1.000 |
| 3 |
4 |
|
G |
62 |
14 |
3288 |
◊ |
E |
x,y,z |
1_555 |
63 |
14 |
4167 |
618.9 |
-5.7 |
0.711 |
28 |
0 |
0 |
1.000 |
| 4 |
5 |
|
D |
53 |
16 |
16560 |
◊ |
C |
x-1,y,z |
1_455 |
47 |
12 |
16494 |
470.7 |
-5.3 |
0.155 |
2 |
0 |
0 |
0.000 |
6 |
|
B |
50 |
15 |
16203 |
◊ |
A |
x-1,y,z |
1_455 |
49 |
16 |
16428 |
428.9 |
-1.9 |
0.404 |
4 |
0 |
0 |
0.000 |
| Average: |
449.8 |
-3.6 |
0.279 |
3 |
0 |
0 |
0.000 |
| 5 |
7 |
|
B |
43 |
17 |
16203 |
◊ |
C |
-x-1,y-1/2,-z-1 |
2_444 |
48 |
18 |
16494 |
403.3 |
1.4 |
0.680 |
2 |
2 |
0 |
0.000 |
| 6 |
8 |
|
B |
46 |
14 |
16203 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
39 |
10 |
16560 |
366.6 |
-0.6 |
0.508 |
10 |
1 |
0 |
0.000 |
| 7 |
9 |
|
F |
34 |
6 |
4125 |
◊ |
A |
x,y,z |
1_555 |
38 |
16 |
16428 |
298.1 |
-3.8 |
0.501 |
6 |
0 |
0 |
0.080 |
| 8 |
10 |
|
H |
40 |
7 |
3331 |
◊ |
A |
x,y,z |
1_555 |
31 |
10 |
16428 |
296.9 |
-0.4 |
0.737 |
8 |
0 |
0 |
0.049 |
| 9 |
11 |
|
G |
38 |
5 |
3288 |
◊ |
C |
x,y,z |
1_555 |
32 |
8 |
16494 |
286.7 |
-0.6 |
0.704 |
5 |
0 |
0 |
0.039 |
| 10 |
12 |
|
E |
34 |
5 |
4167 |
◊ |
C |
x,y,z |
1_555 |
35 |
14 |
16494 |
282.2 |
-0.9 |
0.675 |
6 |
0 |
0 |
0.049 |
| 11 |
13 |
|
E |
29 |
7 |
4167 |
◊ |
B |
x,y,z |
1_555 |
25 |
11 |
16203 |
247.9 |
-3.5 |
0.489 |
4 |
0 |
0 |
0.066 |
| 12 |
14 |
|
[5HC]E:5 |
20 |
1 |
465 |
cf |
E |
x,y,z |
1_555 |
28 |
2 |
4167 |
231.5 |
1.0 |
0.740 |
0 |
0 |
0 |
0.000 |
| 13 |
15 |
|
C |
22 |
8 |
16494 |
◊ |
A |
x,y,z |
1_555 |
31 |
11 |
16428 |
223.0 |
-0.6 |
0.473 |
1 |
0 |
0 |
0.010 |
| 14 |
16 |
|
[5HC]F:5 |
20 |
1 |
466 |
cf |
F |
x,y,z |
1_555 |
27 |
2 |
4125 |
212.4 |
1.4 |
0.777 |
0 |
0 |
0 |
0.000 |
| 15 |
17 |
|
F |
19 |
5 |
4125 |
◊ |
E |
x,y,z |
1_555 |
20 |
5 |
4167 |
205.6 |
-3.9 |
0.463 |
16 |
0 |
0 |
0.153 |
| 16 |
18 |
|
F |
23 |
5 |
4125 |
◊ |
D |
x,y,z |
1_555 |
24 |
11 |
16560 |
201.2 |
-1.8 |
0.555 |
5 |
0 |
0 |
0.055 |
| 17 |
19 |
|
B |
24 |
8 |
16203 |
◊ |
C |
x-1,y,z |
1_455 |
23 |
6 |
16494 |
199.5 |
-0.9 |
0.385 |
0 |
0 |
0 |
0.000 |
20 |
|
D |
22 |
7 |
16560 |
◊ |
A |
x-1,y,z |
1_455 |
12 |
4 |
16428 |
189.5 |
-2.4 |
0.148 |
3 |
0 |
0 |
0.000 |
| Average: |
194.5 |
-1.6 |
0.266 |
2 |
0 |
0 |
0.000 |
| 18 |
21 |
|
B |
16 |
7 |
16203 |
◊ |
D |
x,y,z-1 |
1_554 |
21 |
6 |
16560 |
168.5 |
-3.8 |
0.088 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
G |
23 |
3 |
3288 |
◊ |
D |
x,y,z-1 |
1_554 |
17 |
7 |
16560 |
164.0 |
-0.6 |
0.647 |
3 |
0 |
0 |
0.000 |
| 20 |
23 |
|
F |
18 |
3 |
4125 |
◊ |
B |
x,y,z |
1_555 |
15 |
7 |
16203 |
153.9 |
-2.5 |
0.444 |
2 |
0 |
0 |
0.042 |
| 21 |
24 |
|
G |
22 |
5 |
3288 |
◊ |
B |
x,y,z |
1_555 |
14 |
5 |
16203 |
153.4 |
-0.6 |
0.645 |
1 |
0 |
0 |
0.013 |
| 22 |
25 |
|
G |
16 |
2 |
3288 |
◊ |
F |
x,y,z-1 |
1_554 |
17 |
2 |
4125 |
117.6 |
1.7 |
0.783 |
0 |
0 |
0 |
0.000 |
| 23 |
26 |
|
E |
17 |
2 |
4167 |
◊ |
H |
x,y,z-1 |
1_554 |
16 |
2 |
3331 |
115.0 |
1.4 |
0.765 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
H |
19 |
4 |
3331 |
◊ |
D |
x,y,z |
1_555 |
9 |
5 |
16560 |
104.4 |
-0.7 |
0.661 |
2 |
0 |
0 |
0.022 |
| 25 |
28 |
|
[EDO]C:401 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
16 |
10 |
16494 |
102.2 |
2.7 |
0.286 |
3 |
0 |
0 |
0.000 |
| 26 |
29 |
|
F |
12 |
1 |
4125 |
◊ |
G |
x,y,z |
1_555 |
14 |
1 |
3288 |
92.5 |
0.9 |
0.720 |
0 |
0 |
0 |
0.000 |
| 27 |
30 |
|
A |
11 |
7 |
16428 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
12 |
6 |
16560 |
88.9 |
0.5 |
0.609 |
0 |
0 |
0 |
0.000 |
| 28 |
31 |
|
H |
12 |
1 |
3331 |
◊ |
E |
x,y,z |
1_555 |
10 |
1 |
4167 |
88.7 |
0.1 |
0.653 |
0 |
0 |
0 |
0.000 |
| 29 |
32 |
|
F |
13 |
3 |
4125 |
◊ |
C |
x,y,z |
1_555 |
8 |
5 |
16494 |
85.0 |
-1.9 |
0.493 |
1 |
0 |
0 |
0.032 |
| 30 |
33 |
|
E |
10 |
3 |
4167 |
◊ |
D |
x,y,z-1 |
1_554 |
11 |
2 |
16560 |
80.0 |
-2.1 |
0.423 |
2 |
0 |
0 |
0.000 |
| 31 |
34 |
|
B |
7 |
3 |
16203 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
9 |
5 |
16560 |
77.6 |
0.5 |
0.639 |
1 |
1 |
0 |
0.000 |
| 32 |
35 |
|
[5HC]E:5 |
7 |
1 |
465 |
◊ |
G |
x,y,z |
1_555 |
8 |
4 |
3288 |
72.4 |
1.0 |
0.692 |
3 |
0 |
0 |
0.020 |
| 33 |
36 |
|
H |
7 |
2 |
3331 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
16203 |
68.7 |
1.5 |
0.772 |
0 |
0 |
0 |
0.000 |
| 34 |
37 |
|
[5HC]F:5 |
11 |
1 |
466 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
16428 |
64.9 |
1.5 |
0.766 |
1 |
0 |
0 |
0.000 |
| 35 |
38 |
|
[5HC]F:5 |
5 |
1 |
466 |
◊ |
H |
x,y,z |
1_555 |
7 |
3 |
3331 |
63.7 |
0.6 |
0.645 |
3 |
0 |
0 |
0.053 |
| 36 |
39 |
|
[5HC]E:5 |
7 |
1 |
465 |
◊ |
D |
x,y,z-1 |
1_554 |
10 |
3 |
16560 |
60.7 |
0.9 |
0.681 |
0 |
0 |
0 |
0.000 |
| 37 |
40 |
|
H |
10 |
3 |
3331 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
16494 |
56.1 |
-1.2 |
0.418 |
1 |
0 |
0 |
0.023 |
| 38 |
41 |
|
G |
7 |
1 |
3288 |
◊ |
H |
x,y,z-1 |
1_554 |
7 |
1 |
3331 |
53.3 |
2.3 |
0.822 |
0 |
0 |
0 |
0.000 |
| 39 |
42 |
|
E |
8 |
2 |
4167 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
16428 |
34.8 |
-0.6 |
0.575 |
2 |
0 |
0 |
0.018 |
| 40 |
43 |
|
A |
4 |
2 |
16428 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
5 |
2 |
16494 |
28.4 |
0.3 |
0.675 |
0 |
0 |
0 |
0.000 |
| 41 |
44 |
|
B |
3 |
1 |
16203 |
◊ |
A |
x-1,y,z-1 |
1_454 |
1 |
1 |
16428 |
11.5 |
0.5 |
0.798 |
0 |
0 |
0 |
0.000 |
| 42 |
45 |
|
A |
1 |
1 |
16428 |
◊ |
C |
-x,y-1/2,-z-1 |
2_544 |
2 |
1 |
16494 |
8.4 |
0.3 |
0.798 |
0 |
0 |
0 |
0.000 |
| 43 |
46 |
|
E |
1 |
1 |
4167 |
◊ |
F |
x,y,z-1 |
1_554 |
2 |
1 |
4125 |
2.1 |
-0.2 |
0.279 |
0 |
0 |
0 |
0.000 |
| 44 |
47 |
|
B |
1 |
1 |
16203 |
◊ |
G |
x-1,y,z |
1_455 |
1 |
1 |
3288 |
0.3 |
-0.0 |
0.491 |
0 |
0 |
0 |
0.000 |
|