## |
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 |
86 |
22 |
9963 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
85 |
22 |
9963 |
770.6 |
-9.6 |
0.411 |
8 |
0 |
0 |
0.236 |
2 |
|
C |
77 |
21 |
8594 |
◊ |
B |
x,y,z |
1_555 |
82 |
20 |
9445 |
715.1 |
-10.3 |
0.254 |
8 |
0 |
0 |
0.236 |
Average: |
742.9 |
-10.0 |
0.333 |
8 |
0 |
0 |
0.236 |
2 |
3 |
|
B |
48 |
14 |
9445 |
◊ |
A |
x-1/2,-y-1/2,-z |
8_445 |
43 |
9 |
9963 |
447.1 |
1.7 |
0.873 |
6 |
7 |
0 |
0.000 |
3 |
4 |
|
B |
38 |
12 |
9445 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
36 |
12 |
9963 |
364.8 |
-2.3 |
0.621 |
4 |
0 |
0 |
0.000 |
4 |
5 |
|
[GDP]A:601 |
25 |
1 |
568 |
f |
A |
x,y,z |
1_555 |
39 |
16 |
9963 |
314.4 |
-6.5 |
0.560 |
12 |
0 |
0 |
0.414 |
6 |
|
[GDP]B:601 |
25 |
1 |
566 |
f |
B |
x,y,z |
1_555 |
37 |
15 |
9445 |
313.5 |
-6.5 |
0.537 |
14 |
0 |
0 |
0.414 |
7 |
|
[GDP]C:601 |
25 |
1 |
569 |
f |
C |
x,y,z |
1_555 |
40 |
16 |
8594 |
313.3 |
-6.2 |
0.543 |
12 |
0 |
0 |
0.414 |
Average: |
313.7 |
-6.4 |
0.547 |
13 |
0 |
0 |
0.414 |
5 |
8 |
|
C |
41 |
14 |
8594 |
◊ |
A |
x,y,z |
1_555 |
33 |
14 |
9963 |
311.5 |
-1.3 |
0.605 |
1 |
0 |
0 |
0.044 |
9 |
|
B |
29 |
11 |
9445 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
35 |
11 |
9963 |
290.6 |
-0.1 |
0.734 |
4 |
1 |
0 |
0.044 |
10 |
|
C |
27 |
12 |
8594 |
◊ |
B |
-x,y,-z-1/2 |
3_554 |
36 |
11 |
9445 |
281.7 |
-0.9 |
0.700 |
2 |
0 |
0 |
0.044 |
Average: |
294.6 |
-0.8 |
0.680 |
2 |
0 |
0 |
0.044 |
6 |
11 |
|
C |
29 |
13 |
8594 |
◊ |
C |
-x,y,-z-1/2 |
3_554 |
29 |
13 |
8594 |
283.1 |
-5.9 |
0.145 |
1 |
0 |
1 |
0.203 |
12 |
|
B |
32 |
15 |
9445 |
◊ |
A |
x,y,z |
1_555 |
32 |
14 |
9963 |
268.3 |
-8.6 |
0.067 |
2 |
0 |
1 |
0.203 |
Average: |
275.7 |
-7.3 |
0.106 |
2 |
0 |
1 |
0.203 |
7 |
13 |
|
B |
16 |
4 |
9445 |
◊ |
A |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
35 |
12 |
9963 |
232.4 |
-0.0 |
0.768 |
5 |
2 |
0 |
0.000 |
14 |
|
C |
34 |
12 |
8594 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
18 |
4 |
9963 |
222.5 |
0.6 |
0.768 |
4 |
3 |
0 |
0.000 |
Average: |
227.5 |
0.3 |
0.768 |
5 |
3 |
0 |
0.000 |
8 |
15 |
|
C |
25 |
9 |
8594 |
◊ |
A |
x-1/2,-y-1/2,-z |
8_445 |
24 |
8 |
9963 |
224.0 |
-1.0 |
0.635 |
1 |
0 |
0 |
0.000 |
9 |
16 |
|
B |
19 |
4 |
9445 |
◊ |
A |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
25 |
9 |
9963 |
214.7 |
0.2 |
0.719 |
4 |
2 |
0 |
0.000 |
10 |
17 |
|
C |
23 |
10 |
8594 |
◊ |
C |
x,-y-1,-z |
4_545 |
23 |
10 |
8594 |
150.6 |
-1.2 |
0.609 |
0 |
0 |
0 |
0.000 |
11 |
18 |
|
C |
2 |
1 |
8594 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
2 |
1 |
9963 |
45.2 |
-1.4 |
0.062 |
0 |
0 |
0 |
0.017 |
19 |
|
B |
2 |
1 |
9445 |
◊ |
B |
-x,y,-z-1/2 |
3_554 |
2 |
1 |
9445 |
43.8 |
-1.4 |
0.064 |
0 |
0 |
0 |
0.017 |
Average: |
44.5 |
-1.4 |
0.063 |
0 |
0 |
0 |
0.017 |
12 |
20 |
|
[MG]A:602 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
9963 |
41.1 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.185 |
21 |
|
[MG]B:602 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
9445 |
41.0 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.185 |
22 |
|
[MG]C:602 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
8594 |
40.5 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.185 |
Average: |
40.9 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.185 |
13 |
23 |
|
[MG]C:602 |
1 |
1 |
98 |
f |
[GDP]C:601 |
x,y,z |
1_555 |
4 |
1 |
569 |
33.3 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.176 |
24 |
|
[MG]A:602 |
1 |
1 |
98 |
f |
[GDP]A:601 |
x,y,z |
1_555 |
4 |
1 |
568 |
32.7 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.176 |
25 |
|
[MG]B:602 |
1 |
1 |
98 |
f |
[GDP]B:601 |
x,y,z |
1_555 |
4 |
1 |
566 |
31.9 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.176 |
Average: |
32.6 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.176 |
14 |
26 |
|
[GDP]A:601 |
1 |
1 |
568 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
9445 |
24.7 |
-2.3 |
0.044 |
1 |
0 |
0 |
0.086 |
27 |
|
[GDP]B:601 |
1 |
1 |
566 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
9963 |
24.2 |
-2.3 |
0.049 |
1 |
0 |
0 |
0.086 |
28 |
|
[GDP]C:601 |
1 |
1 |
569 |
◊ |
C |
-x,y,-z-1/2 |
3_554 |
1 |
1 |
8594 |
23.6 |
-2.2 |
0.046 |
1 |
0 |
0 |
0.086 |
Average: |
24.2 |
-2.3 |
0.047 |
1 |
0 |
0 |
0.086 |
15 |
29 |
|
[GDP]C:601 |
3 |
1 |
569 |
◊ |
[GDP]C:601 |
-x,y,-z-1/2 |
3_554 |
3 |
1 |
569 |
16.7 |
-0.5 |
0.574 |
0 |
0 |
0 |
0.008 |
30 |
|
[GDP]B:601 |
2 |
1 |
566 |
◊ |
[GDP]A:601 |
x,y,z |
1_555 |
2 |
1 |
568 |
9.3 |
-0.4 |
0.475 |
0 |
0 |
0 |
0.008 |
Average: |
13.0 |
-0.4 |
0.525 |
0 |
0 |
0 |
0.008 |
16 |
31 |
|
[MG]B:602 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
9963 |
7.8 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.029 |
32 |
|
[MG]C:602 |
1 |
1 |
98 |
◊ |
C |
-x,y,-z-1/2 |
3_554 |
1 |
1 |
8594 |
6.5 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.029 |
33 |
|
[MG]A:602 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
9445 |
6.1 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.029 |
Average: |
6.8 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.029 |
|