| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
86 |
12 |
3947 |
◊ |
A |
x,y,z |
1_555 |
104 |
31 |
8339 |
834.1 |
-17.5 |
0.571 |
17 |
0 |
0 |
0.342 |
2 |
|
A |
83 |
23 |
8339 |
◊ |
A |
-x+1,-y,z |
2_655 |
83 |
23 |
8339 |
809.9 |
-0.5 |
0.540 |
16 |
4 |
0 |
0.000 |
3 |
|
A |
30 |
9 |
8339 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
5_545 |
40 |
8 |
3947 |
293.6 |
-5.8 |
0.687 |
4 |
0 |
0 |
0.152 |
4 |
|
A |
20 |
7 |
8339 |
x |
A |
-y+1/2,x-1/2,z-1/2 |
3_544 |
16 |
4 |
8339 |
154.0 |
-1.5 |
0.334 |
1 |
0 |
0 |
0.000 |
5 |
|
[EDO]A:601 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
8339 |
108.3 |
3.6 |
0.596 |
5 |
0 |
0 |
0.000 |
6 |
|
[EDO]B:102 |
4 |
1 |
181 |
f |
B |
x,y,z |
1_555 |
17 |
5 |
3947 |
86.8 |
2.2 |
0.328 |
2 |
0 |
0 |
0.000 |
7 |
|
[EDO]A:603 |
3 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
8339 |
82.8 |
2.8 |
0.511 |
4 |
0 |
0 |
0.000 |
8 |
|
[EDO]A:602 |
4 |
1 |
184 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
5_545 |
14 |
4 |
3947 |
74.7 |
2.2 |
0.551 |
0 |
0 |
0 |
0.000 |
9 |
|
A |
14 |
6 |
8339 |
◊ |
[EDO]B:101 |
-x+1/2,y-1/2,-z+1/2 |
5_545 |
4 |
1 |
184 |
71.9 |
2.2 |
0.268 |
2 |
0 |
0 |
0.000 |
10 |
|
[CL]B:105 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
3947 |
63.5 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.195 |
11 |
|
[EDO]A:604 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
8339 |
62.5 |
1.7 |
0.796 |
2 |
0 |
0 |
0.000 |
12 |
|
[CL]A:606 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
8339 |
61.9 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.136 |
13 |
|
[NA]A:605 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
8339 |
60.3 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.199 |
14 |
|
[NA]B:104 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
3947 |
59.4 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.159 |
15 |
|
[EDO]B:101 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
3947 |
57.0 |
0.2 |
0.866 |
1 |
0 |
0 |
0.005 |
16 |
|
[EDO]A:602 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
8339 |
46.7 |
1.0 |
0.722 |
0 |
0 |
0 |
0.000 |
17 |
|
[MG]B:103 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
3947 |
45.3 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.124 |
18 |
|
[EDO]A:603 |
3 |
1 |
182 |
◊ |
A |
-y+1/2,x-1/2,z-1/2 |
3_544 |
6 |
2 |
8339 |
45.1 |
1.1 |
0.792 |
0 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:604 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
5 |
1 |
3947 |
40.8 |
-0.2 |
0.735 |
2 |
0 |
0 |
0.022 |
20 |
|
[CL]B:105 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
8339 |
28.6 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.048 |
21 |
|
[NA]B:104 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
6 |
4 |
8339 |
26.8 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.044 |
22 |
|
[NA]A:605 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
3947 |
26.3 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.041 |
23 |
|
A |
4 |
1 |
8339 |
x |
A |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
1 |
1 |
8339 |
25.6 |
-0.3 |
0.212 |
0 |
0 |
0 |
0.000 |
24 |
|
A |
4 |
1 |
8339 |
◊ |
[MG]B:103 |
-x+1/2,y-1/2,-z+1/2 |
5_545 |
1 |
1 |
98 |
24.6 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.058 |
25 |
|
[CL]A:606 |
1 |
1 |
125 |
◊ |
[EDO]B:101 |
-x+1/2,y-1/2,-z+1/2 |
5_545 |
3 |
1 |
184 |
21.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.031 |
26 |
|
[CL]A:606 |
1 |
1 |
125 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
5_545 |
4 |
1 |
3947 |
20.0 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.044 |
27 |
|
[CL]A:606 |
1 |
1 |
125 |
f |
[EDO]A:601 |
x,y,z |
1_555 |
2 |
1 |
182 |
17.1 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.025 |
28 |
|
[MG]B:103 |
1 |
1 |
98 |
f |
[EDO]B:101 |
x,y,z |
1_555 |
1 |
1 |
184 |
9.3 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.017 |
29 |
|
[EDO]A:602 |
3 |
1 |
184 |
◊ |
[EDO]B:101 |
-x+1/2,y-1/2,-z+1/2 |
5_545 |
1 |
1 |
184 |
7.6 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
30 |
|
A |
3 |
2 |
8339 |
◊ |
[EDO]A:604 |
-y+1/2,x-1/2,z-1/2 |
3_544 |
2 |
1 |
183 |
6.2 |
0.3 |
0.827 |
0 |
0 |
0 |
0.000 |
|