| ## |
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 |
79 |
20 |
8747 |
◊ |
A |
x,y,z |
1_555 |
79 |
20 |
12771 |
723.3 |
-5.0 |
0.286 |
9 |
2 |
0 |
0.000 |
| 2 |
2 |
|
A |
66 |
25 |
12771 |
◊ |
B |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
64 |
19 |
8747 |
568.9 |
1.3 |
0.630 |
6 |
1 |
0 |
0.000 |
| 3 |
3 |
|
[0O2]B:209 |
35 |
1 |
725 |
f |
B |
x,y,z |
1_555 |
52 |
22 |
8747 |
427.4 |
0.3 |
0.714 |
14 |
0 |
0 |
0.096 |
| 4 |
4 |
|
B |
39 |
12 |
8747 |
◊ |
B |
-x-1,y,-z+1/2 |
3_455 |
39 |
12 |
8747 |
397.2 |
-1.8 |
0.412 |
6 |
6 |
0 |
0.044 |
| 5 |
5 |
|
A |
34 |
12 |
12771 |
◊ |
A |
x,-y,-z-1 |
4_554 |
34 |
12 |
12771 |
372.7 |
-3.6 |
0.208 |
0 |
0 |
0 |
0.000 |
| 6 |
6 |
|
A |
15 |
4 |
12771 |
x |
A |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
25 |
8 |
12771 |
197.6 |
-1.8 |
0.194 |
1 |
0 |
0 |
0.000 |
| 7 |
7 |
|
A |
12 |
5 |
12771 |
◊ |
B |
x,y,z-1 |
1_554 |
13 |
4 |
8747 |
112.2 |
-1.1 |
0.380 |
0 |
0 |
0 |
0.000 |
| 8 |
8 |
|
[GOL]B:205 |
6 |
1 |
211 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
8747 |
95.3 |
1.2 |
0.805 |
1 |
0 |
0 |
0.000 |
| 9 |
9 |
|
A |
14 |
5 |
12771 |
◊ |
[GOL]B:206 |
x,y,z-1 |
1_554 |
6 |
1 |
217 |
77.4 |
0.9 |
0.719 |
0 |
0 |
0 |
0.000 |
| 10 |
10 |
|
[CL]A:301 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
4 |
12771 |
68.2 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.100 |
| 11 |
11 |
|
[GOL]B:206 |
5 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
8747 |
59.4 |
-0.3 |
0.526 |
0 |
0 |
0 |
0.005 |
| 12 |
12 |
|
[CL]B:207 |
1 |
1 |
125 |
f |
[CL]B:207 |
-x-1,y,-z+1/2 |
3_455 |
1 |
1 |
125 |
53.4 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.100 |
| 13 |
13 |
|
[CL]B:207 |
1 |
1 |
125 |
x |
B |
x,y,z |
1_555 |
10 |
3 |
8747 |
49.3 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.219 |
| 14 |
14 |
|
[MG]B:201 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
8747 |
36.4 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.118 |
15 |
|
[MG]B:204 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
8747 |
32.6 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.118 |
| Average: |
34.5 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.118 |
| 15 |
16 |
|
A |
6 |
3 |
12771 |
◊ |
[0O2]B:209 |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
3 |
1 |
725 |
36.0 |
0.5 |
0.621 |
1 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[MG]B:203 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
8747 |
29.8 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.072 |
| 17 |
18 |
|
[MG]B:202 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
8747 |
28.8 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.068 |
| 18 |
19 |
|
[F]B:208 |
1 |
1 |
104 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
8747 |
28.6 |
0.9 |
0.804 |
0 |
0 |
0 |
0.000 |
| 19 |
20 |
|
[0O2]B:209 |
4 |
1 |
725 |
f |
[MG]B:204 |
x,y,z |
1_555 |
1 |
1 |
98 |
24.3 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.025 |
| 20 |
21 |
|
[0O2]B:209 |
3 |
1 |
725 |
f |
[MG]B:203 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.9 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.023 |
| 21 |
22 |
|
[0O2]B:209 |
3 |
1 |
725 |
f |
[F]B:208 |
x,y,z |
1_555 |
1 |
1 |
104 |
22.8 |
0.7 |
0.773 |
0 |
0 |
0 |
0.000 |
| 22 |
23 |
|
[F]B:208 |
1 |
1 |
104 |
f |
[MG]B:204 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.4 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.023 |
| 23 |
24 |
|
[F]B:208 |
1 |
1 |
104 |
f |
[MG]B:202 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.3 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.023 |
| 24 |
25 |
|
[F]B:208 |
1 |
1 |
104 |
f |
[MG]B:203 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.1 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.023 |
| 25 |
26 |
|
[MG]B:204 |
1 |
1 |
98 |
f |
[MG]B:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
13.3 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.043 |
| 26 |
27 |
|
[MG]B:202 |
1 |
1 |
98 |
f |
[MG]B:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.9 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.038 |
| 27 |
28 |
|
[MG]B:204 |
1 |
1 |
98 |
f |
[MG]B:202 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.6 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.034 |
| 28 |
29 |
|
[F]B:208 |
1 |
1 |
104 |
f |
[MG]B:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.4 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.018 |
| 29 |
30 |
|
[MG]B:203 |
1 |
1 |
98 |
f |
[MG]B:202 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.3 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.033 |
| 30 |
31 |
|
[0O2]B:209 |
2 |
1 |
725 |
f |
[MG]B:202 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.2 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.008 |
| 31 |
32 |
|
[MG]B:204 |
1 |
1 |
98 |
f |
[MG]B:203 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.6 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.028 |
| 32 |
33 |
|
[0O2]B:209 |
1 |
1 |
725 |
f |
[MG]B:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.2 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.009 |
|