| ## |
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 |
98 |
19 |
2069 |
◊ |
C |
x,y,z |
1_555 |
115 |
28 |
8323 |
960.4 |
-11.9 |
0.405 |
4 |
8 |
0 |
1.000 |
2 |
|
B |
91 |
18 |
2390 |
◊ |
A |
x,y,z |
1_555 |
112 |
27 |
7874 |
914.7 |
-12.1 |
0.340 |
7 |
9 |
0 |
1.000 |
| Average: |
937.6 |
-12.0 |
0.372 |
6 |
9 |
0 |
1.000 |
| 2 |
3 |
|
A |
40 |
12 |
7874 |
◊ |
C |
x,y,z-1 |
1_554 |
32 |
12 |
8323 |
314.9 |
-1.9 |
0.484 |
0 |
0 |
0 |
0.000 |
4 |
|
C |
40 |
12 |
8323 |
◊ |
A |
x,y,z |
1_555 |
31 |
12 |
7874 |
313.6 |
-1.0 |
0.530 |
3 |
0 |
0 |
0.000 |
| Average: |
314.3 |
-1.4 |
0.507 |
2 |
0 |
0 |
0.000 |
| 3 |
5 |
|
B |
31 |
7 |
2390 |
◊ |
C |
x,y,z |
1_555 |
39 |
12 |
8323 |
301.6 |
-1.3 |
0.563 |
0 |
0 |
0 |
0.000 |
6 |
|
A |
39 |
11 |
7874 |
◊ |
D |
x,y,z-1 |
1_554 |
28 |
7 |
2069 |
275.7 |
-1.2 |
0.545 |
0 |
0 |
0 |
0.000 |
| Average: |
288.7 |
-1.2 |
0.554 |
0 |
0 |
0 |
0.000 |
| 4 |
7 |
|
C |
34 |
9 |
8323 |
x |
C |
x,y-1,z |
1_545 |
33 |
9 |
8323 |
296.3 |
1.1 |
0.668 |
1 |
1 |
0 |
0.000 |
| 5 |
8 |
|
C |
33 |
7 |
8323 |
◊ |
A |
x-1,y,z+1 |
1_456 |
37 |
12 |
7874 |
281.8 |
0.2 |
0.663 |
1 |
0 |
0 |
0.000 |
9 |
|
C |
30 |
10 |
8323 |
◊ |
A |
x-1,y,z |
1_455 |
28 |
7 |
7874 |
254.2 |
-1.0 |
0.514 |
1 |
0 |
0 |
0.000 |
| Average: |
268.0 |
-0.4 |
0.588 |
1 |
0 |
0 |
0.000 |
| 6 |
10 |
|
C |
22 |
7 |
8323 |
◊ |
A |
x-1,y-1,z |
1_445 |
30 |
7 |
7874 |
228.4 |
1.1 |
0.707 |
2 |
6 |
0 |
0.000 |
| 7 |
11 |
|
C |
26 |
7 |
8323 |
x |
C |
x-1,y,z |
1_455 |
23 |
6 |
8323 |
214.4 |
1.9 |
0.776 |
1 |
0 |
0 |
0.000 |
12 |
|
A |
21 |
6 |
7874 |
x |
A |
x-1,y,z |
1_455 |
24 |
7 |
7874 |
204.2 |
1.3 |
0.635 |
2 |
0 |
0 |
0.000 |
| Average: |
209.3 |
1.6 |
0.705 |
2 |
0 |
0 |
0.000 |
| 8 |
13 |
|
A |
23 |
6 |
7874 |
x |
A |
x,y-1,z |
1_545 |
22 |
6 |
7874 |
196.2 |
-0.9 |
0.504 |
1 |
0 |
0 |
0.000 |
| 9 |
14 |
|
[EDO]A:201 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
17 |
9 |
7874 |
111.4 |
4.2 |
0.544 |
0 |
0 |
0 |
0.000 |
| 10 |
15 |
|
[TAR]A:203 |
9 |
1 |
263 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
7874 |
104.0 |
1.2 |
0.637 |
2 |
0 |
0 |
0.000 |
| 11 |
16 |
|
C |
9 |
3 |
8323 |
◊ |
A |
x,y-1,z |
1_545 |
12 |
3 |
7874 |
104.0 |
-2.2 |
0.184 |
0 |
0 |
0 |
0.000 |
| 12 |
17 |
|
[EDO]C:203 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
16 |
7 |
8323 |
88.7 |
3.2 |
0.521 |
2 |
0 |
0 |
0.000 |
| 13 |
18 |
|
A |
10 |
5 |
7874 |
f |
[TAR]A:202 |
x-1,y,z |
1_455 |
7 |
1 |
265 |
80.7 |
-0.5 |
0.368 |
3 |
0 |
0 |
0.154 |
| 14 |
19 |
|
D |
10 |
4 |
2069 |
◊ |
A |
x-1,y,z+1 |
1_456 |
14 |
6 |
7874 |
77.6 |
0.7 |
0.787 |
0 |
0 |
0 |
0.000 |
20 |
|
C |
13 |
5 |
8323 |
◊ |
B |
x-1,y,z |
1_455 |
11 |
4 |
2390 |
75.5 |
-0.2 |
0.669 |
0 |
0 |
0 |
0.000 |
| Average: |
76.6 |
0.2 |
0.728 |
0 |
0 |
0 |
0.000 |
| 15 |
21 |
|
D |
11 |
4 |
2069 |
◊ |
[TAR]A:202 |
x-1,y,z+1 |
1_456 |
7 |
1 |
265 |
75.7 |
-1.2 |
0.389 |
0 |
0 |
0 |
0.000 |
| 16 |
22 |
|
[TAR]C:201 |
7 |
1 |
267 |
f |
B |
x-1,y,z |
1_455 |
12 |
4 |
2390 |
73.5 |
-1.1 |
0.413 |
0 |
0 |
0 |
0.065 |
| 17 |
23 |
|
[TAR]A:202 |
8 |
1 |
265 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
7874 |
69.9 |
1.7 |
0.715 |
2 |
0 |
0 |
0.000 |
| 18 |
24 |
|
[TAR]C:201 |
7 |
1 |
267 |
◊ |
C |
x-1,y,z |
1_455 |
9 |
5 |
8323 |
69.8 |
-0.7 |
0.375 |
0 |
0 |
0 |
0.000 |
| 19 |
25 |
|
[TAR]C:201 |
8 |
1 |
267 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
8323 |
62.8 |
1.5 |
0.709 |
1 |
0 |
0 |
0.000 |
| 20 |
26 |
|
[EDO]C:202 |
4 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
8323 |
58.2 |
1.1 |
0.800 |
1 |
0 |
0 |
0.000 |
| 21 |
27 |
|
[EDO]C:202 |
4 |
1 |
183 |
◊ |
B |
x-1,y,z |
1_455 |
6 |
3 |
2390 |
52.6 |
0.8 |
0.667 |
0 |
0 |
0 |
0.000 |
| 22 |
28 |
|
C |
2 |
1 |
8323 |
◊ |
B |
x,y-1,z |
1_545 |
7 |
2 |
2390 |
49.2 |
-0.9 |
0.150 |
0 |
0 |
0 |
0.000 |
| 23 |
29 |
|
C |
3 |
3 |
8323 |
◊ |
B |
x-1,y-1,z |
1_445 |
4 |
2 |
2390 |
39.5 |
0.5 |
0.500 |
0 |
0 |
0 |
0.000 |
| 24 |
30 |
|
C |
4 |
1 |
8323 |
◊ |
D |
x,y-1,z |
1_545 |
5 |
2 |
2069 |
39.4 |
1.1 |
0.883 |
0 |
3 |
0 |
0.000 |
| 25 |
31 |
|
[EDO]C:202 |
2 |
1 |
183 |
f |
A |
x-1,y,z |
1_455 |
4 |
2 |
7874 |
36.5 |
0.6 |
0.437 |
0 |
0 |
0 |
0.000 |
| 26 |
32 |
|
[TAR]C:201 |
6 |
1 |
267 |
f |
[EDO]C:203 |
x-1,y,z |
1_455 |
4 |
1 |
184 |
36.0 |
1.1 |
0.647 |
0 |
0 |
0 |
0.000 |
| 27 |
33 |
|
[TAR]A:203 |
5 |
1 |
263 |
f |
C |
x,y,z-1 |
1_554 |
5 |
4 |
8323 |
32.0 |
-0.8 |
0.415 |
0 |
0 |
0 |
0.141 |
| 28 |
34 |
|
C |
6 |
4 |
8323 |
◊ |
[EDO]C:203 |
x-1,y,z |
1_455 |
3 |
1 |
184 |
31.1 |
0.5 |
0.702 |
0 |
0 |
0 |
0.000 |
| 29 |
35 |
|
[EDO]C:202 |
2 |
1 |
183 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
1 |
8323 |
24.1 |
1.2 |
0.933 |
0 |
0 |
0 |
0.000 |
| 30 |
36 |
|
C |
2 |
2 |
8323 |
◊ |
[TAR]A:203 |
x-1,y,z+1 |
1_456 |
4 |
1 |
263 |
21.0 |
0.4 |
0.574 |
0 |
0 |
0 |
0.000 |
| 31 |
37 |
|
C |
3 |
2 |
8323 |
◊ |
[TAR]A:202 |
x-1,y,z+1 |
1_456 |
4 |
1 |
265 |
18.0 |
0.3 |
0.578 |
0 |
0 |
0 |
0.000 |
| 32 |
38 |
|
[TAR]C:201 |
3 |
1 |
267 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
2 |
7874 |
15.2 |
0.4 |
0.624 |
0 |
0 |
0 |
0.000 |
| 33 |
39 |
|
D |
1 |
1 |
2069 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
2390 |
11.2 |
-0.0 |
0.531 |
0 |
0 |
0 |
0.000 |
| 34 |
40 |
|
C |
4 |
3 |
8323 |
f |
[EDO]A:201 |
x-1,y,z+1 |
1_456 |
3 |
1 |
184 |
9.0 |
0.2 |
0.840 |
0 |
0 |
0 |
0.000 |
| 35 |
41 |
|
B |
1 |
1 |
2390 |
◊ |
A |
x,y-1,z |
1_545 |
2 |
2 |
7874 |
4.1 |
0.2 |
0.782 |
0 |
0 |
0 |
0.000 |
| 36 |
42 |
|
[EDO]C:203 |
1 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
2390 |
0.7 |
0.0 |
0.776 |
0 |
0 |
0 |
0.000 |
|