## |
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 |
|
A |
171 |
43 |
10430 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
169 |
43 |
10430 |
1605.5 |
-28.5 |
0.019 |
12 |
2 |
0 |
1.000 |
2 |
|
B |
170 |
43 |
10587 |
◊ |
B |
-y-1,-x-1,-z-1/2 |
8_444 |
166 |
42 |
10587 |
1603.0 |
-28.6 |
0.008 |
12 |
2 |
0 |
1.000 |
Average: |
1604.2 |
-28.6 |
0.013 |
12 |
2 |
0 |
1.000 |
2 |
3 |
|
A |
49 |
14 |
10430 |
◊ |
B |
-y-1,-x,-z-1/2 |
8_454 |
50 |
15 |
10587 |
486.5 |
-3.1 |
0.555 |
6 |
0 |
0 |
0.000 |
3 |
4 |
|
[OS5]B:307 |
25 |
1 |
754 |
◊ |
B |
x,y,z |
1_555 |
49 |
21 |
10587 |
326.2 |
2.9 |
0.491 |
3 |
0 |
0 |
0.000 |
5 |
|
[OS5]A:308 |
26 |
1 |
754 |
◊ |
A |
x,y,z |
1_555 |
49 |
21 |
10430 |
322.4 |
2.6 |
0.488 |
3 |
0 |
0 |
0.000 |
Average: |
324.3 |
2.7 |
0.490 |
3 |
0 |
0 |
0.000 |
4 |
6 |
|
A |
37 |
13 |
10430 |
◊ |
B |
-y-1/2,x+1/2,z+1/4 |
3_455 |
32 |
8 |
10587 |
269.3 |
-4.3 |
0.224 |
1 |
0 |
0 |
0.000 |
5 |
7 |
|
B |
29 |
10 |
10587 |
◊ |
A |
x,y,z |
1_555 |
30 |
9 |
10430 |
265.0 |
1.3 |
0.846 |
4 |
2 |
0 |
0.000 |
6 |
8 |
|
[OS5]B:307 |
16 |
1 |
754 |
f |
B |
-y-1,-x-1,-z-1/2 |
8_444 |
23 |
6 |
10587 |
166.5 |
-1.4 |
0.157 |
0 |
0 |
0 |
0.159 |
7 |
9 |
|
[OS5]A:308 |
15 |
1 |
754 |
f |
A |
-y,-x,-z-1/2 |
8_554 |
23 |
6 |
10430 |
162.9 |
-1.4 |
0.183 |
0 |
0 |
0 |
0.139 |
8 |
10 |
|
B |
16 |
4 |
10587 |
◊ |
A |
x-1/2,-y-1/2,-z-1/4 |
6_444 |
20 |
7 |
10430 |
146.8 |
-1.1 |
0.467 |
1 |
1 |
0 |
0.000 |
9 |
11 |
|
A |
15 |
5 |
10430 |
x |
A |
x-1/2,-y-1/2,-z-1/4 |
6_444 |
14 |
5 |
10430 |
122.1 |
0.4 |
0.762 |
2 |
2 |
0 |
0.000 |
10 |
12 |
|
[EDO]B:301 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
18 |
6 |
10587 |
114.4 |
3.5 |
0.482 |
5 |
0 |
0 |
0.000 |
11 |
13 |
|
[EDO]A:306 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
19 |
6 |
10430 |
113.7 |
3.5 |
0.492 |
6 |
0 |
0 |
0.000 |
12 |
14 |
|
[EDO]B:304 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
25 |
10 |
10587 |
106.9 |
3.3 |
0.473 |
1 |
0 |
0 |
0.000 |
13 |
15 |
|
[EDO]A:303 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
18 |
7 |
10430 |
95.8 |
2.8 |
0.484 |
1 |
0 |
0 |
0.000 |
14 |
16 |
|
B |
13 |
3 |
10587 |
◊ |
A |
-y-1,-x,-z-1/2 |
8_454 |
12 |
4 |
10430 |
93.0 |
0.0 |
0.688 |
1 |
2 |
0 |
0.000 |
15 |
17 |
|
[OS5]A:308 |
10 |
1 |
754 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
10587 |
89.0 |
0.2 |
0.391 |
0 |
0 |
0 |
0.000 |
16 |
18 |
|
[EDO]A:307 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
10587 |
79.2 |
2.5 |
0.447 |
0 |
0 |
0 |
0.000 |
17 |
19 |
|
[EDO]B:302 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
12 |
3 |
10587 |
76.0 |
2.2 |
0.290 |
0 |
0 |
0 |
0.000 |
18 |
20 |
|
[EDO]B:303 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
10587 |
75.2 |
2.1 |
0.544 |
1 |
0 |
0 |
0.000 |
19 |
21 |
|
[EDO]A:302 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
13 |
3 |
10430 |
71.1 |
2.6 |
0.297 |
0 |
0 |
0 |
0.000 |
20 |
22 |
|
[EDO]A:305 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
10430 |
70.0 |
2.8 |
0.334 |
0 |
0 |
0 |
0.000 |
21 |
23 |
|
[EDO]B:305 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
11 |
3 |
10587 |
66.6 |
1.4 |
0.257 |
1 |
0 |
0 |
0.000 |
22 |
24 |
|
A |
10 |
3 |
10430 |
f |
[EDO]A:305 |
x-1/2,-y-1/2,-z-1/4 |
6_444 |
4 |
1 |
185 |
63.0 |
1.6 |
0.771 |
0 |
0 |
0 |
0.000 |
23 |
25 |
|
[EDO]A:304 |
4 |
1 |
186 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
9 |
3 |
10430 |
60.5 |
1.7 |
0.773 |
0 |
0 |
0 |
0.000 |
24 |
26 |
|
[EDO]B:305 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
10430 |
58.9 |
1.2 |
0.785 |
1 |
0 |
0 |
0.000 |
25 |
27 |
|
[EDO]A:304 |
3 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
10430 |
56.9 |
1.4 |
0.279 |
1 |
0 |
0 |
0.000 |
26 |
28 |
|
[EDO]A:301 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
10430 |
54.7 |
0.9 |
0.820 |
3 |
0 |
0 |
0.042 |
27 |
29 |
|
[NH4]B:306 |
1 |
1 |
117 |
x |
B |
x,y,z |
1_555 |
8 |
4 |
10587 |
50.6 |
0.8 |
0.778 |
0 |
0 |
0 |
0.000 |
28 |
30 |
|
B |
6 |
2 |
10587 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
9 |
5 |
10430 |
49.1 |
-0.8 |
0.416 |
0 |
0 |
0 |
0.000 |
29 |
31 |
|
B |
8 |
2 |
10587 |
x |
B |
-x-1/2,y-1/2,-z-3/4 |
5_444 |
6 |
2 |
10587 |
47.6 |
-0.1 |
0.576 |
0 |
1 |
0 |
0.000 |
30 |
32 |
|
[EDO]A:302 |
4 |
1 |
182 |
f |
[EDO]A:302 |
-y,-x,-z-1/2 |
8_554 |
4 |
1 |
182 |
46.4 |
1.5 |
1.000 |
2 |
0 |
0 |
0.000 |
31 |
33 |
|
[EDO]B:302 |
3 |
1 |
185 |
◊ |
[EDO]B:302 |
-y-1,-x-1,-z-1/2 |
8_444 |
3 |
1 |
185 |
45.8 |
1.9 |
1.000 |
0 |
0 |
0 |
0.000 |
32 |
34 |
|
[OS5]A:308 |
7 |
1 |
754 |
◊ |
[EDO]B:305 |
x,y,z |
1_555 |
4 |
1 |
184 |
40.8 |
1.3 |
0.494 |
0 |
0 |
0 |
0.000 |
33 |
35 |
|
[EDO]A:301 |
3 |
1 |
183 |
◊ |
[OS5]B:307 |
-y-1/2,x+1/2,z+1/4 |
3_455 |
7 |
1 |
754 |
40.2 |
1.4 |
0.164 |
0 |
0 |
0 |
0.000 |
34 |
36 |
|
[EDO]A:301 |
3 |
1 |
183 |
◊ |
B |
-y-1/2,x+1/2,z+1/4 |
3_455 |
3 |
1 |
10587 |
36.6 |
1.2 |
0.931 |
1 |
0 |
0 |
0.000 |
35 |
37 |
|
B |
7 |
2 |
10587 |
◊ |
[EDO]A:301 |
x-1/2,-y-1/2,-z-1/4 |
6_444 |
2 |
1 |
183 |
33.8 |
0.8 |
0.467 |
0 |
0 |
0 |
0.000 |
36 |
38 |
|
[EDO]A:303 |
3 |
1 |
185 |
f |
A |
-y,-x,-z-1/2 |
8_554 |
6 |
2 |
10430 |
33.7 |
0.6 |
0.849 |
1 |
0 |
0 |
0.000 |
37 |
39 |
|
[EDO]A:307 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
10430 |
30.5 |
0.2 |
0.713 |
0 |
0 |
0 |
0.000 |
38 |
40 |
|
[EDO]A:303 |
2 |
1 |
185 |
◊ |
[EDO]A:302 |
x,y,z |
1_555 |
2 |
1 |
182 |
24.8 |
1.1 |
1.000 |
0 |
0 |
0 |
0.000 |
39 |
41 |
|
[EDO]B:302 |
1 |
1 |
185 |
f |
B |
-y-1,-x-1,-z-1/2 |
8_444 |
4 |
2 |
10587 |
22.5 |
0.2 |
0.757 |
0 |
0 |
0 |
0.000 |
40 |
42 |
|
[EDO]A:304 |
1 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
2 |
1 |
10587 |
20.2 |
-0.0 |
0.495 |
0 |
0 |
0 |
0.005 |
41 |
43 |
|
[EDO]A:302 |
2 |
1 |
182 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
5 |
2 |
10430 |
19.1 |
0.3 |
0.799 |
0 |
0 |
0 |
0.000 |
42 |
44 |
|
[EDO]B:301 |
2 |
1 |
184 |
f |
B |
-y-1,-x-1,-z-1/2 |
8_444 |
1 |
1 |
10587 |
16.1 |
0.7 |
0.937 |
0 |
0 |
0 |
0.000 |
43 |
45 |
|
[EDO]A:306 |
2 |
1 |
185 |
f |
A |
-y,-x,-z-1/2 |
8_554 |
1 |
1 |
10430 |
15.2 |
0.7 |
0.937 |
0 |
0 |
0 |
0.000 |
44 |
46 |
|
A |
1 |
1 |
10430 |
f |
[EDO]B:303 |
-y-1,-x,-z-1/2 |
8_454 |
2 |
1 |
185 |
7.1 |
0.1 |
0.530 |
0 |
0 |
0 |
0.000 |
|