## |
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 |
447 |
109 |
21219 |
◊ |
A |
x,y,z |
1_555 |
443 |
108 |
21305 |
4067.2 |
-40.0 |
0.007 |
77 |
18 |
0 |
1.000 |
2 |
2 |
|
A |
40 |
13 |
21305 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
51 |
17 |
21219 |
407.6 |
2.6 |
0.727 |
8 |
2 |
0 |
0.000 |
3 |
3 |
|
B |
29 |
9 |
21219 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
28 |
8 |
21219 |
294.7 |
-2.8 |
0.246 |
2 |
0 |
0 |
0.000 |
4 |
|
A |
27 |
7 |
21305 |
x |
A |
-x,y-1/2,-z |
2_545 |
30 |
9 |
21305 |
267.5 |
-2.5 |
0.248 |
3 |
0 |
0 |
0.000 |
Average: |
281.1 |
-2.7 |
0.247 |
3 |
0 |
0 |
0.000 |
4 |
5 |
|
A |
22 |
6 |
21305 |
◊ |
B |
x,y,z-1 |
1_554 |
23 |
6 |
21219 |
214.2 |
-3.2 |
0.175 |
2 |
0 |
0 |
0.000 |
5 |
6 |
|
[EDO]A:606 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
21 |
9 |
21305 |
122.4 |
3.3 |
0.538 |
0 |
0 |
0 |
0.000 |
6 |
7 |
|
[EDO]A:607 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
20 |
11 |
21305 |
113.5 |
3.7 |
0.606 |
5 |
0 |
0 |
0.000 |
7 |
8 |
|
[PO4]B:601 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
21 |
11 |
21219 |
110.6 |
-4.7 |
0.816 |
7 |
0 |
0 |
0.154 |
8 |
9 |
|
[PO4]A:601 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
20 |
11 |
21305 |
109.7 |
-4.9 |
0.814 |
5 |
0 |
0 |
0.139 |
9 |
10 |
|
[EDO]A:605 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
21305 |
97.8 |
4.1 |
0.570 |
2 |
0 |
0 |
0.000 |
10 |
11 |
|
[EDO]A:603 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
16 |
7 |
21305 |
89.0 |
2.1 |
0.433 |
3 |
0 |
0 |
0.000 |
11 |
12 |
|
[EDO]B:602 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
16 |
7 |
21219 |
87.5 |
2.1 |
0.264 |
2 |
0 |
0 |
0.000 |
12 |
13 |
|
[EDO]B:603 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
18 |
7 |
21219 |
83.2 |
2.0 |
0.405 |
3 |
0 |
0 |
0.000 |
13 |
14 |
|
[EDO]A:602 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
21305 |
82.3 |
2.1 |
0.403 |
2 |
0 |
0 |
0.000 |
14 |
15 |
|
[EDO]A:604 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
12 |
7 |
21305 |
81.8 |
3.5 |
0.569 |
3 |
0 |
0 |
0.000 |
15 |
16 |
|
[EDO]A:603 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
21219 |
62.0 |
0.9 |
0.576 |
1 |
0 |
0 |
0.000 |
16 |
17 |
|
[EDO]A:602 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
21219 |
58.7 |
1.1 |
0.198 |
1 |
0 |
0 |
0.000 |
17 |
18 |
|
[EDO]B:602 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
21305 |
57.4 |
0.9 |
0.590 |
1 |
0 |
0 |
0.000 |
18 |
19 |
|
[EDO]B:603 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
21305 |
56.6 |
1.3 |
0.196 |
0 |
0 |
0 |
0.000 |
19 |
20 |
|
[EDO]A:604 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
2 |
2 |
21219 |
34.1 |
1.7 |
0.988 |
1 |
0 |
0 |
0.000 |
20 |
21 |
|
[EDO]A:605 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
21219 |
28.0 |
0.9 |
0.819 |
0 |
0 |
0 |
0.000 |
21 |
22 |
|
[PO4]A:601 |
4 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
21219 |
26.8 |
-1.2 |
0.841 |
0 |
0 |
0 |
0.016 |
22 |
23 |
|
[EDO]A:605 |
2 |
1 |
184 |
f |
[EDO]A:604 |
x,y,z |
1_555 |
2 |
1 |
184 |
25.7 |
0.9 |
1.000 |
1 |
0 |
0 |
0.000 |
23 |
24 |
|
[EDO]A:604 |
3 |
1 |
184 |
f |
[PO4]B:601 |
x,y,z |
1_555 |
3 |
1 |
188 |
24.1 |
-1.0 |
0.996 |
1 |
0 |
0 |
0.028 |
24 |
25 |
|
[EDO]B:602 |
2 |
1 |
186 |
◊ |
[EDO]A:603 |
x,y,z |
1_555 |
2 |
1 |
185 |
17.3 |
1.0 |
1.000 |
0 |
0 |
0 |
0.000 |
25 |
26 |
|
[PO4]B:601 |
4 |
1 |
188 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
21305 |
16.9 |
-0.9 |
0.806 |
0 |
0 |
0 |
0.012 |
26 |
27 |
|
A |
2 |
1 |
21305 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
3 |
2 |
21219 |
14.9 |
0.0 |
0.590 |
0 |
0 |
0 |
0.000 |
27 |
28 |
|
[EDO]A:605 |
1 |
1 |
184 |
f |
[PO4]B:601 |
x,y,z |
1_555 |
3 |
1 |
188 |
9.7 |
-0.3 |
0.996 |
0 |
0 |
0 |
0.005 |
28 |
29 |
|
[EDO]A:606 |
1 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
21219 |
1.1 |
0.0 |
0.713 |
0 |
0 |
0 |
0.000 |
|