## |
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 |
178 |
55 |
15904 |
◊ |
A |
x,y,z |
1_555 |
177 |
56 |
15893 |
1717.2 |
-18.6 |
0.079 |
19 |
4 |
0 |
0.429 |
2 |
2 |
|
A |
74 |
22 |
15893 |
x |
A |
-x+1/2,y-1/2,-z |
4_545 |
64 |
20 |
15893 |
583.3 |
-1.2 |
0.531 |
5 |
3 |
0 |
0.000 |
3 |
3 |
|
B |
54 |
17 |
15904 |
x |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
50 |
16 |
15904 |
459.5 |
-2.5 |
0.395 |
3 |
2 |
0 |
0.000 |
4 |
4 |
|
B |
34 |
10 |
15904 |
x |
B |
x-1/2,y-1/2,z |
3_445 |
33 |
7 |
15904 |
297.4 |
-3.4 |
0.278 |
3 |
0 |
0 |
0.000 |
5 |
5 |
|
A |
29 |
12 |
15893 |
x |
A |
x,y-1,z |
1_545 |
32 |
9 |
15893 |
208.7 |
1.2 |
0.759 |
3 |
2 |
0 |
0.000 |
6 |
6 |
|
A |
21 |
9 |
15893 |
x |
A |
x-1/2,y+1/2,z |
3_455 |
28 |
9 |
15893 |
191.9 |
-1.5 |
0.434 |
2 |
0 |
0 |
0.000 |
7 |
7 |
|
[EDO]A:404 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
6 |
15893 |
106.6 |
2.7 |
0.394 |
2 |
0 |
0 |
0.000 |
8 |
8 |
|
A |
11 |
5 |
15893 |
x |
A |
x-1/2,y-1/2,z |
3_445 |
13 |
5 |
15893 |
68.1 |
-0.1 |
0.602 |
0 |
0 |
0 |
0.000 |
9 |
9 |
|
[CL]B:403 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
15904 |
61.4 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.139 |
10 |
10 |
|
[MG]B:401 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
8 |
15904 |
61.4 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.232 |
11 |
|
[MG]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
15893 |
56.1 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.232 |
Average: |
58.7 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.232 |
11 |
12 |
|
[CL]A:403 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
15893 |
54.6 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.106 |
12 |
13 |
|
[CL]A:403 |
1 |
1 |
125 |
◊ |
A |
x,y-1,z |
1_545 |
6 |
2 |
15893 |
43.4 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.000 |
13 |
14 |
|
[MG]A:402 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
15893 |
37.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.062 |
14 |
15 |
|
B |
3 |
2 |
15904 |
x |
B |
x,y-1,z |
1_545 |
3 |
2 |
15904 |
26.6 |
-0.2 |
0.419 |
0 |
0 |
0 |
0.000 |
15 |
16 |
|
B |
6 |
4 |
15904 |
◊ |
[MG]B:402 |
x-1/2,y-1/2,z |
3_445 |
1 |
1 |
98 |
21.6 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[MG]A:402 |
1 |
1 |
98 |
◊ |
A |
x,y-1,z |
1_545 |
5 |
2 |
15893 |
19.6 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
B |
4 |
2 |
15904 |
f |
[MG]B:402 |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
98 |
19.4 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.034 |
18 |
19 |
|
[MG]B:402 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
15904 |
18.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
19 |
20 |
|
A |
1 |
1 |
15893 |
◊ |
A |
-x+1,y,-z |
2_655 |
2 |
2 |
15893 |
17.3 |
0.6 |
0.891 |
0 |
0 |
0 |
0.000 |
20 |
21 |
|
A |
1 |
1 |
15893 |
◊ |
B |
x,y-1,z |
1_545 |
3 |
1 |
15904 |
14.0 |
0.7 |
0.859 |
0 |
0 |
0 |
0.000 |
21 |
22 |
|
[MG]A:401 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
15904 |
9.9 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.025 |
23 |
|
[MG]B:401 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
15893 |
9.7 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.025 |
Average: |
9.8 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.025 |
22 |
24 |
|
B |
2 |
2 |
15904 |
◊ |
B |
-x,y,-z+1 |
2_556 |
2 |
2 |
15904 |
9.3 |
0.2 |
0.752 |
0 |
0 |
0 |
0.000 |
23 |
25 |
|
B |
1 |
1 |
15904 |
◊ |
A |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
15893 |
1.7 |
-0.0 |
0.572 |
0 |
0 |
0 |
0.000 |
|