## |
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 |
|
C |
34 |
8 |
1879 |
◊ |
B |
x,y,z |
1_555 |
31 |
8 |
1915 |
337.6 |
-6.6 |
0.477 |
14 |
0 |
0 |
0.981 |
2 |
|
A |
33 |
8 |
1918 |
◊ |
A |
x,x-y,-z+1/6 |
9_555 |
33 |
8 |
1918 |
334.3 |
-5.9 |
0.487 |
14 |
0 |
0 |
0.981 |
Average: |
336.0 |
-6.2 |
0.482 |
14 |
0 |
0 |
0.981 |
2 |
3 |
|
[MWB]C:101 |
25 |
1 |
571 |
◊ |
C |
x,y,z |
1_555 |
35 |
6 |
1879 |
229.0 |
5.2 |
0.456 |
1 |
0 |
0 |
0.000 |
4 |
|
[MWB]B:101 |
25 |
1 |
567 |
◊ |
B |
x,y,z |
1_555 |
34 |
6 |
1915 |
222.0 |
5.8 |
0.471 |
0 |
0 |
0 |
0.000 |
5 |
|
[MWB]A:101 |
25 |
1 |
574 |
◊ |
A |
x,x-y,-z+1/6 |
9_555 |
32 |
6 |
1918 |
211.5 |
5.8 |
0.471 |
1 |
0 |
0 |
0.000 |
Average: |
220.8 |
5.6 |
0.466 |
1 |
0 |
0 |
0.000 |
3 |
6 |
|
[MWB]C:101 |
21 |
1 |
571 |
◊ |
B |
x,y,z |
1_555 |
25 |
5 |
1915 |
170.2 |
-0.6 |
0.387 |
0 |
0 |
0 |
0.000 |
7 |
|
[MWB]B:101 |
21 |
1 |
567 |
◊ |
C |
x,y,z |
1_555 |
23 |
5 |
1879 |
166.3 |
-0.3 |
0.384 |
0 |
0 |
0 |
0.000 |
8 |
|
[MWB]A:101 |
21 |
1 |
574 |
◊ |
A |
x,y,z |
1_555 |
24 |
5 |
1918 |
154.0 |
-0.3 |
0.370 |
0 |
0 |
0 |
0.000 |
Average: |
163.5 |
-0.4 |
0.380 |
0 |
0 |
0 |
0.000 |
4 |
9 |
|
C |
16 |
1 |
1879 |
◊ |
A |
x,x-y,-z+1/6 |
9_555 |
18 |
2 |
1918 |
136.7 |
2.6 |
0.795 |
0 |
0 |
0 |
0.000 |
10 |
|
C |
18 |
2 |
1879 |
◊ |
B |
x,x-y-1,-z+1/6 |
9_545 |
15 |
1 |
1915 |
131.5 |
2.9 |
0.802 |
0 |
0 |
0 |
0.000 |
Average: |
134.1 |
2.7 |
0.799 |
0 |
0 |
0 |
0.000 |
5 |
11 |
|
B |
20 |
2 |
1915 |
◊ |
A |
x,y,z |
1_555 |
16 |
2 |
1918 |
136.2 |
1.4 |
0.735 |
0 |
0 |
0 |
0.000 |
6 |
12 |
|
B |
12 |
3 |
1915 |
◊ |
A |
x-y,x,z+1/6 |
2_555 |
12 |
3 |
1918 |
86.5 |
-2.4 |
0.442 |
0 |
0 |
0 |
0.000 |
7 |
13 |
|
[MWB]A:101 |
9 |
1 |
574 |
f |
B |
y,x,-z+1/3 |
10_555 |
8 |
2 |
1915 |
75.8 |
-1.4 |
0.316 |
2 |
0 |
0 |
0.100 |
8 |
14 |
|
[MWB]B:101 |
8 |
1 |
567 |
◊ |
[MWB]A:101 |
x,y,z |
1_555 |
9 |
1 |
574 |
60.0 |
0.0 |
0.222 |
0 |
0 |
0 |
0.000 |
15 |
|
[MWB]C:101 |
9 |
1 |
571 |
◊ |
[MWB]C:101 |
x,x-y-1,-z+1/6 |
9_545 |
9 |
1 |
571 |
59.2 |
-0.5 |
0.175 |
0 |
0 |
0 |
0.000 |
Average: |
59.6 |
-0.2 |
0.198 |
0 |
0 |
0 |
0.000 |
9 |
16 |
|
[MWB]C:101 |
2 |
1 |
571 |
◊ |
B |
x,x-y-1,-z+1/6 |
9_545 |
5 |
1 |
1915 |
42.4 |
-1.0 |
0.215 |
0 |
0 |
0 |
0.000 |
17 |
|
[MWB]A:101 |
2 |
1 |
574 |
◊ |
C |
x,y,z |
1_555 |
5 |
1 |
1879 |
37.8 |
-0.5 |
0.279 |
0 |
0 |
0 |
0.000 |
Average: |
40.1 |
-0.7 |
0.247 |
0 |
0 |
0 |
0.000 |
10 |
18 |
|
[MWB]B:101 |
3 |
1 |
567 |
f |
A |
x,y,z |
1_555 |
5 |
1 |
1918 |
39.1 |
-0.5 |
0.271 |
0 |
0 |
0 |
0.100 |
11 |
19 |
|
B |
4 |
1 |
1915 |
◊ |
A |
x,x-y,-z+1/6 |
9_555 |
4 |
1 |
1918 |
36.3 |
1.4 |
0.729 |
0 |
0 |
0 |
0.000 |
20 |
|
C |
4 |
1 |
1879 |
◊ |
C |
x,x-y-1,-z+1/6 |
9_545 |
4 |
1 |
1879 |
35.7 |
1.4 |
0.744 |
0 |
0 |
0 |
0.000 |
Average: |
36.0 |
1.4 |
0.737 |
0 |
0 |
0 |
0.000 |
12 |
21 |
|
B |
3 |
2 |
1915 |
◊ |
B |
y,x,-z+1/3 |
10_555 |
3 |
2 |
1915 |
33.4 |
-1.1 |
0.386 |
0 |
0 |
0 |
0.000 |
13 |
22 |
|
[MWB]C:101 |
2 |
1 |
571 |
◊ |
[MWB]B:101 |
x,y,z |
1_555 |
2 |
1 |
567 |
30.7 |
-1.0 |
0.170 |
0 |
0 |
0 |
0.000 |
23 |
|
[MWB]A:101 |
2 |
1 |
574 |
◊ |
[MWB]A:101 |
x,x-y,-z+1/6 |
9_555 |
2 |
1 |
574 |
28.3 |
-0.9 |
0.149 |
0 |
0 |
0 |
0.000 |
Average: |
29.5 |
-0.9 |
0.159 |
0 |
0 |
0 |
0.000 |
14 |
24 |
|
A |
4 |
1 |
1918 |
◊ |
A |
y,x,-z+1/3 |
10_555 |
4 |
1 |
1918 |
27.3 |
-1.0 |
0.431 |
0 |
0 |
0 |
0.000 |
15 |
25 |
|
[MWB]B:101 |
3 |
1 |
567 |
◊ |
B |
y,x,-z+1/3 |
10_555 |
2 |
1 |
1915 |
26.6 |
-1.6 |
0.208 |
1 |
0 |
0 |
0.000 |
16 |
26 |
|
B |
5 |
1 |
1915 |
◊ |
B |
x,x-y-1,-z+1/6 |
9_545 |
5 |
1 |
1915 |
21.9 |
-1.0 |
0.469 |
0 |
0 |
0 |
0.000 |
17 |
27 |
|
C |
5 |
1 |
1879 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
1918 |
21.3 |
-1.0 |
0.465 |
0 |
0 |
0 |
0.000 |
18 |
28 |
|
[MWB]B:101 |
3 |
1 |
567 |
◊ |
A |
x,x-y,-z+1/6 |
9_555 |
3 |
2 |
1918 |
11.0 |
0.4 |
0.453 |
0 |
0 |
0 |
0.000 |
29 |
|
[MWB]C:101 |
2 |
1 |
571 |
◊ |
C |
x,x-y-1,-z+1/6 |
9_545 |
1 |
1 |
1879 |
10.6 |
0.3 |
0.505 |
0 |
0 |
0 |
0.000 |
30 |
|
[MWB]A:101 |
2 |
1 |
574 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
1915 |
8.0 |
0.3 |
0.495 |
0 |
0 |
0 |
0.000 |
Average: |
9.9 |
0.3 |
0.484 |
0 |
0 |
0 |
0.000 |
19 |
31 |
|
[MWB]A:101 |
3 |
1 |
574 |
◊ |
A |
y,x,-z+1/3 |
10_555 |
1 |
1 |
1918 |
10.6 |
-0.4 |
0.219 |
0 |
0 |
0 |
0.000 |
20 |
32 |
|
B |
2 |
1 |
1915 |
◊ |
A |
y,x,-z+1/3 |
10_555 |
3 |
1 |
1918 |
7.6 |
0.2 |
0.491 |
0 |
0 |
0 |
0.000 |
|