| ## |
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 |
|
D |
55 |
8 |
4754 |
◊ |
C |
x,y,z |
1_555 |
54 |
8 |
4732 |
448.1 |
2.2 |
0.975 |
16 |
0 |
0 |
0.000 |
2 |
|
B |
54 |
8 |
4734 |
◊ |
A |
x,y,z |
1_555 |
55 |
8 |
4736 |
442.7 |
1.9 |
0.974 |
16 |
0 |
0 |
0.000 |
| Average: |
445.4 |
2.0 |
0.974 |
16 |
0 |
0 |
0.000 |
| 2 |
3 |
|
D |
36 |
10 |
4754 |
◊ |
D |
-x+1,y,-z |
2_655 |
36 |
10 |
4754 |
256.4 |
-0.9 |
0.903 |
8 |
0 |
0 |
0.000 |
4 |
|
C |
29 |
8 |
4732 |
◊ |
C |
-x,y,-z |
2_555 |
30 |
8 |
4732 |
229.9 |
-0.5 |
0.882 |
6 |
0 |
0 |
0.000 |
5 |
|
A |
30 |
8 |
4736 |
◊ |
A |
-x,y,-z-1 |
2_554 |
29 |
8 |
4736 |
229.7 |
-0.6 |
0.881 |
6 |
0 |
0 |
0.000 |
6 |
|
B |
29 |
8 |
4734 |
◊ |
B |
-x-1,y,-z-1 |
2_454 |
30 |
8 |
4734 |
226.9 |
-1.1 |
0.871 |
6 |
0 |
0 |
0.000 |
| Average: |
235.7 |
-0.8 |
0.884 |
7 |
0 |
0 |
0.000 |
| 3 |
7 |
|
[5BU]C:2 |
20 |
1 |
443 |
cf |
C |
x,y,z |
1_555 |
33 |
5 |
4732 |
245.7 |
2.4 |
0.876 |
2 |
0 |
0 |
0.000 |
8 |
|
[5BU]B:2 |
20 |
1 |
445 |
cf |
B |
x,y,z |
1_555 |
34 |
5 |
4734 |
245.1 |
2.2 |
0.865 |
2 |
0 |
0 |
0.000 |
9 |
|
[5BU]A:2 |
21 |
1 |
444 |
cf |
A |
x,y,z |
1_555 |
34 |
5 |
4736 |
244.3 |
2.3 |
0.875 |
2 |
0 |
0 |
0.000 |
10 |
|
[5BU]D:2 |
20 |
1 |
445 |
cf |
D |
x,y,z |
1_555 |
34 |
5 |
4754 |
243.2 |
2.3 |
0.868 |
2 |
0 |
0 |
0.000 |
| Average: |
244.6 |
2.3 |
0.871 |
2 |
0 |
0 |
0.000 |
| 4 |
11 |
|
B |
31 |
2 |
4734 |
◊ |
A |
x-1,y+1,z |
1_465 |
31 |
2 |
4736 |
192.2 |
4.6 |
0.973 |
0 |
0 |
0 |
0.000 |
12 |
|
C |
31 |
2 |
4732 |
◊ |
D |
x-1,y-1,z |
1_445 |
31 |
2 |
4754 |
189.8 |
4.7 |
0.973 |
0 |
0 |
0 |
0.000 |
| Average: |
191.0 |
4.6 |
0.973 |
0 |
0 |
0 |
0.000 |
| 5 |
13 |
|
C |
21 |
6 |
4732 |
◊ |
D |
x-1,y,z |
1_455 |
22 |
6 |
4754 |
180.6 |
-5.4 |
0.590 |
0 |
0 |
0 |
0.000 |
14 |
|
B |
23 |
6 |
4734 |
◊ |
A |
x-1,y,z |
1_455 |
22 |
6 |
4736 |
179.9 |
-5.5 |
0.605 |
0 |
0 |
0 |
0.000 |
| Average: |
180.3 |
-5.5 |
0.597 |
0 |
0 |
0 |
0.000 |
| 6 |
15 |
|
D |
18 |
3 |
4754 |
◊ |
C |
-x,y,-z |
2_555 |
20 |
5 |
4732 |
163.0 |
-0.8 |
0.753 |
1 |
0 |
0 |
0.000 |
16 |
|
D |
20 |
5 |
4754 |
◊ |
C |
-x+1,y,-z |
2_655 |
19 |
3 |
4732 |
163.0 |
-1.2 |
0.744 |
1 |
0 |
0 |
0.000 |
17 |
|
B |
19 |
3 |
4734 |
◊ |
A |
-x,y,-z-1 |
2_554 |
20 |
5 |
4736 |
162.7 |
-1.0 |
0.755 |
1 |
0 |
0 |
0.000 |
18 |
|
B |
19 |
4 |
4734 |
◊ |
A |
-x-1,y,-z-1 |
2_454 |
19 |
3 |
4736 |
160.4 |
-1.2 |
0.739 |
1 |
0 |
0 |
0.000 |
| Average: |
162.3 |
-1.0 |
0.748 |
1 |
0 |
0 |
0.000 |
| 7 |
19 |
|
[K]A:24 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
4736 |
101.7 |
-67.5 |
0.000 |
0 |
0 |
0 |
0.077 |
20 |
|
[K]B:24 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
4734 |
101.6 |
-67.3 |
0.000 |
0 |
0 |
0 |
0.077 |
21 |
|
[K]D:24 |
1 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
4754 |
99.9 |
-66.2 |
0.000 |
0 |
0 |
0 |
0.077 |
22 |
|
[K]C:24 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
4732 |
98.8 |
-64.8 |
0.000 |
0 |
0 |
0 |
0.077 |
| Average: |
100.5 |
-66.5 |
0.000 |
0 |
0 |
0 |
0.077 |
| 8 |
23 |
|
C |
8 |
3 |
4732 |
◊ |
B |
x,y-1,z |
1_545 |
13 |
4 |
4734 |
76.8 |
-1.3 |
0.612 |
0 |
0 |
0 |
0.000 |
| 9 |
24 |
|
D |
9 |
2 |
4754 |
◊ |
A |
x,y,z |
1_555 |
9 |
2 |
4736 |
75.4 |
-0.7 |
0.675 |
0 |
0 |
0 |
0.000 |
| 10 |
25 |
|
[5BU]C:2 |
7 |
1 |
443 |
◊ |
B |
x,y-1,z |
1_545 |
8 |
2 |
4734 |
70.1 |
-1.3 |
0.539 |
0 |
0 |
0 |
0.000 |
| 11 |
26 |
|
[5BU]A:2 |
5 |
1 |
444 |
◊ |
D |
x,y,z |
1_555 |
9 |
3 |
4754 |
59.1 |
-1.3 |
0.492 |
0 |
0 |
0 |
0.000 |
| 12 |
27 |
|
[K]C:24 |
1 |
1 |
216 |
f |
[5BU]C:2 |
x,y,z |
1_555 |
8 |
1 |
443 |
45.8 |
-24.4 |
0.000 |
0 |
0 |
0 |
0.028 |
28 |
|
[K]A:24 |
1 |
1 |
216 |
f |
[5BU]A:2 |
x,y,z |
1_555 |
8 |
1 |
444 |
44.9 |
-23.4 |
0.000 |
0 |
0 |
0 |
0.028 |
29 |
|
[K]B:24 |
1 |
1 |
216 |
f |
[5BU]B:2 |
x,y,z |
1_555 |
8 |
1 |
445 |
42.2 |
-21.9 |
0.000 |
0 |
0 |
0 |
0.028 |
30 |
|
[K]D:24 |
1 |
1 |
216 |
f |
[5BU]D:2 |
x,y,z |
1_555 |
8 |
1 |
445 |
41.5 |
-21.7 |
0.000 |
0 |
0 |
0 |
0.028 |
| Average: |
43.6 |
-22.9 |
0.000 |
0 |
0 |
0 |
0.028 |
| 13 |
31 |
|
B |
1 |
1 |
4734 |
◊ |
[5BU]D:2 |
x-1,y,z |
1_455 |
2 |
1 |
445 |
14.1 |
-0.6 |
0.318 |
0 |
0 |
0 |
0.000 |
| 14 |
32 |
|
C |
1 |
1 |
4732 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
4736 |
0.6 |
0.0 |
0.532 |
0 |
0 |
0 |
0.000 |
|