| ## |
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 |
|
C |
254 |
74 |
30319 |
◊ |
B |
x-1,y,z+1 |
1_456 |
246 |
75 |
30790 |
2221.4 |
-23.7 |
0.045 |
13 |
4 |
0 |
1.000 |
| 2 |
2 |
|
B |
90 |
24 |
30790 |
◊ |
A |
x,y,z |
1_555 |
98 |
28 |
29711 |
834.0 |
0.7 |
0.745 |
8 |
14 |
0 |
0.190 |
| 3 |
3 |
|
C |
95 |
25 |
30319 |
◊ |
A |
x-1,y,z |
1_455 |
88 |
27 |
29711 |
810.9 |
3.9 |
0.875 |
6 |
6 |
0 |
0.000 |
| 4 |
4 |
|
C |
81 |
25 |
30319 |
◊ |
A |
x,y,z |
1_555 |
72 |
29 |
29711 |
657.4 |
-2.5 |
0.318 |
6 |
5 |
0 |
0.000 |
| 5 |
5 |
|
C |
71 |
27 |
30319 |
◊ |
A |
x,y-1,z |
1_545 |
66 |
24 |
29711 |
585.1 |
-3.1 |
0.389 |
0 |
1 |
0 |
0.013 |
| 6 |
6 |
|
[MAL]A:703 |
22 |
1 |
454 |
f |
A |
x,y,z |
1_555 |
53 |
19 |
29711 |
303.0 |
-0.4 |
0.420 |
5 |
0 |
0 |
0.100 |
| 7 |
7 |
|
B |
26 |
7 |
30790 |
◊ |
A |
x,y-1,z |
1_545 |
27 |
9 |
29711 |
222.3 |
0.6 |
0.706 |
1 |
2 |
0 |
0.000 |
| 8 |
8 |
|
A |
22 |
7 |
29711 |
x |
A |
x,y-1,z |
1_545 |
29 |
8 |
29711 |
197.1 |
1.1 |
0.761 |
1 |
1 |
0 |
0.000 |
| 9 |
9 |
|
B |
22 |
7 |
30790 |
◊ |
C |
x,y,z-1 |
1_554 |
28 |
13 |
30319 |
189.1 |
3.9 |
0.888 |
3 |
2 |
0 |
0.000 |
| 10 |
10 |
|
[EDO]B:702 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
24 |
12 |
30790 |
123.2 |
3.1 |
0.567 |
1 |
0 |
0 |
0.000 |
| 11 |
11 |
|
[EDO]A:701 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
22 |
11 |
29711 |
115.7 |
2.6 |
0.473 |
0 |
0 |
0 |
0.000 |
| 12 |
12 |
|
[EDO]B:701 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
30790 |
115.5 |
4.0 |
0.673 |
2 |
0 |
0 |
0.000 |
| 13 |
13 |
|
[EDO]A:702 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
24 |
12 |
29711 |
106.9 |
2.9 |
0.596 |
3 |
0 |
0 |
0.000 |
| 14 |
14 |
|
[EDO]C:701 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
18 |
9 |
30319 |
103.3 |
4.1 |
0.676 |
5 |
0 |
0 |
0.000 |
| 15 |
15 |
|
[IOD]B:703 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
30790 |
91.6 |
0.1 |
0.751 |
0 |
0 |
0 |
0.025 |
16 |
|
[IOD]A:704 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
13 |
9 |
29711 |
86.9 |
-0.4 |
0.611 |
0 |
0 |
0 |
0.025 |
17 |
|
[IOD]C:702 |
1 |
1 |
144 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
30319 |
83.0 |
-0.4 |
0.610 |
0 |
0 |
0 |
0.025 |
| Average: |
87.1 |
-0.2 |
0.657 |
0 |
0 |
0 |
0.025 |
| 16 |
18 |
|
[IOD]A:706 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
29711 |
83.1 |
-0.6 |
0.579 |
0 |
0 |
0 |
0.023 |
| 17 |
19 |
|
[IOD]C:703 |
1 |
1 |
144 |
◊ |
C |
x,y,z |
1_555 |
13 |
6 |
30319 |
75.7 |
0.0 |
0.739 |
0 |
0 |
0 |
0.000 |
20 |
|
[IOD]B:704 |
1 |
1 |
144 |
◊ |
B |
x,y,z |
1_555 |
14 |
6 |
30790 |
73.8 |
-0.0 |
0.729 |
0 |
0 |
0 |
0.000 |
21 |
|
[IOD]A:705 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
29711 |
72.5 |
-0.1 |
0.728 |
0 |
0 |
0 |
0.000 |
| Average: |
74.0 |
-0.0 |
0.732 |
0 |
0 |
0 |
0.000 |
| 18 |
22 |
|
B |
5 |
3 |
30790 |
x |
B |
x-1,y,z |
1_455 |
10 |
4 |
30790 |
67.5 |
0.1 |
0.615 |
0 |
0 |
0 |
0.000 |
| 19 |
23 |
|
[IOD]B:705 |
1 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
30790 |
66.6 |
-0.1 |
0.729 |
0 |
0 |
0 |
0.002 |
| 20 |
24 |
|
[IOD]B:705 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
29711 |
61.1 |
0.4 |
0.856 |
0 |
0 |
0 |
0.000 |
| 21 |
25 |
|
B |
4 |
2 |
30790 |
x |
B |
x,y-1,z |
1_545 |
7 |
3 |
30790 |
39.6 |
0.7 |
0.755 |
1 |
1 |
0 |
0.000 |
| 22 |
26 |
|
[EDO]A:702 |
4 |
1 |
185 |
f |
[EDO]A:701 |
x,y,z |
1_555 |
4 |
1 |
185 |
34.9 |
1.2 |
1.000 |
1 |
0 |
0 |
0.000 |
| 23 |
27 |
|
C |
1 |
1 |
30319 |
f |
[IOD]A:705 |
x,y-1,z |
1_545 |
1 |
1 |
144 |
18.5 |
-0.3 |
0.320 |
0 |
0 |
0 |
0.012 |
| 24 |
28 |
|
C |
3 |
2 |
30319 |
x |
C |
x-1,y,z |
1_455 |
3 |
2 |
30319 |
5.4 |
-0.1 |
0.561 |
0 |
0 |
0 |
0.000 |
| 25 |
29 |
|
A |
1 |
1 |
29711 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
29711 |
0.6 |
-0.0 |
0.594 |
0 |
0 |
0 |
0.000 |
|