## |
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 |
86 |
28 |
11826 |
◊ |
C |
x,y,z |
1_555 |
89 |
27 |
11762 |
711.0 |
-11.3 |
0.156 |
1 |
0 |
0 |
0.033 |
2 |
|
A |
82 |
27 |
11668 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
84 |
27 |
11895 |
695.1 |
-10.5 |
0.177 |
1 |
0 |
0 |
0.033 |
Average: |
703.0 |
-10.9 |
0.166 |
1 |
0 |
0 |
0.033 |
2 |
3 |
|
C |
37 |
14 |
11762 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
36 |
9 |
11895 |
340.5 |
2.0 |
0.873 |
5 |
3 |
0 |
0.000 |
4 |
|
D |
35 |
9 |
11826 |
◊ |
A |
x,y,z |
1_555 |
37 |
15 |
11668 |
331.2 |
0.8 |
0.835 |
4 |
2 |
0 |
0.000 |
Average: |
335.9 |
1.4 |
0.854 |
5 |
3 |
0 |
0.000 |
3 |
5 |
|
D |
38 |
11 |
11826 |
◊ |
B |
x,y,z |
1_555 |
37 |
9 |
11895 |
328.5 |
-1.2 |
0.647 |
5 |
3 |
0 |
0.000 |
6 |
|
B |
33 |
10 |
11895 |
◊ |
D |
x-1,y,z |
1_455 |
31 |
7 |
11826 |
294.7 |
-1.8 |
0.544 |
8 |
3 |
0 |
0.000 |
Average: |
311.6 |
-1.5 |
0.596 |
7 |
3 |
0 |
0.000 |
4 |
7 |
|
C |
30 |
8 |
11762 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
33 |
12 |
11668 |
295.2 |
-0.3 |
0.495 |
2 |
3 |
0 |
0.000 |
5 |
8 |
|
C |
33 |
12 |
11762 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
31 |
10 |
11826 |
292.7 |
-3.8 |
0.294 |
4 |
2 |
0 |
0.000 |
6 |
9 |
|
B |
28 |
9 |
11895 |
◊ |
A |
x,y,z |
1_555 |
26 |
10 |
11668 |
244.9 |
-1.9 |
0.481 |
4 |
5 |
0 |
0.000 |
7 |
10 |
|
C |
24 |
7 |
11762 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
20 |
7 |
11895 |
211.4 |
-1.4 |
0.533 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
13 |
7 |
11668 |
◊ |
D |
x,y,z-1 |
1_554 |
14 |
7 |
11826 |
133.3 |
0.8 |
0.757 |
3 |
1 |
0 |
0.000 |
9 |
12 |
|
B |
14 |
5 |
11895 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
11 |
6 |
11668 |
95.8 |
1.9 |
0.906 |
0 |
0 |
0 |
0.000 |
10 |
13 |
|
[K]C:402 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
11762 |
82.6 |
-63.8 |
0.000 |
0 |
0 |
0 |
0.354 |
14 |
|
A |
14 |
6 |
11668 |
f |
[K]B:404 |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
216 |
82.2 |
-63.7 |
0.000 |
0 |
0 |
0 |
0.354 |
15 |
|
[K]B:402 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
11895 |
82.1 |
-63.6 |
0.000 |
0 |
0 |
0 |
0.354 |
16 |
|
[K]D:403 |
1 |
1 |
216 |
f |
D |
x,y,z |
1_555 |
14 |
6 |
11826 |
82.1 |
-63.5 |
0.000 |
0 |
0 |
0 |
0.354 |
Average: |
82.3 |
-63.7 |
0.000 |
0 |
0 |
0 |
0.354 |
11 |
17 |
|
[CL]C:401 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
11762 |
72.3 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.066 |
18 |
|
[CL]A:401 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
11668 |
71.9 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.066 |
19 |
|
[CL]D:401 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
11826 |
71.9 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.066 |
20 |
|
[CL]B:401 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
11895 |
71.6 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.066 |
Average: |
71.9 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.066 |
12 |
21 |
|
A |
14 |
8 |
11668 |
◊ |
[K]B:403 |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
216 |
62.0 |
-37.9 |
0.000 |
0 |
0 |
0 |
0.209 |
22 |
|
[K]D:402 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
13 |
7 |
11762 |
61.8 |
-37.4 |
0.000 |
0 |
0 |
0 |
0.209 |
23 |
|
[K]D:402 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
14 |
7 |
11826 |
61.5 |
-37.7 |
0.000 |
0 |
0 |
0 |
0.209 |
24 |
|
[K]B:403 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
14 |
7 |
11895 |
61.0 |
-37.1 |
0.000 |
0 |
0 |
0 |
0.209 |
Average: |
61.6 |
-37.5 |
0.000 |
0 |
0 |
0 |
0.209 |
13 |
25 |
|
C |
7 |
3 |
11762 |
◊ |
D |
x,y-1,z |
1_545 |
13 |
7 |
11826 |
56.8 |
2.0 |
0.929 |
0 |
0 |
0 |
0.000 |
14 |
26 |
|
[K]D:403 |
1 |
1 |
216 |
◊ |
[K]D:402 |
x,y,z |
1_555 |
1 |
1 |
216 |
37.3 |
-37.3 |
0.000 |
0 |
0 |
0 |
0.104 |
15 |
27 |
|
[K]B:404 |
1 |
1 |
216 |
◊ |
[K]B:403 |
x,y,z |
1_555 |
1 |
1 |
216 |
37.0 |
-37.0 |
0.000 |
0 |
0 |
0 |
0.103 |
16 |
28 |
|
[K]B:403 |
1 |
1 |
216 |
◊ |
[K]B:402 |
x,y,z |
1_555 |
1 |
1 |
216 |
36.5 |
-36.5 |
0.000 |
0 |
0 |
0 |
0.102 |
17 |
29 |
|
[K]D:402 |
1 |
1 |
216 |
◊ |
[K]C:402 |
x,y,z |
1_555 |
1 |
1 |
216 |
36.0 |
-36.0 |
0.000 |
0 |
0 |
0 |
0.100 |
18 |
30 |
|
[K]C:402 |
1 |
1 |
216 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
11826 |
33.6 |
-19.7 |
0.000 |
0 |
0 |
0 |
0.108 |
31 |
|
[K]D:403 |
1 |
1 |
216 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
11762 |
33.6 |
-19.3 |
0.000 |
0 |
0 |
0 |
0.108 |
32 |
|
A |
4 |
2 |
11668 |
◊ |
[K]B:402 |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
216 |
33.4 |
-19.5 |
0.000 |
0 |
0 |
0 |
0.108 |
33 |
|
[K]B:404 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
11895 |
32.6 |
-18.9 |
0.000 |
0 |
0 |
0 |
0.108 |
Average: |
33.3 |
-19.3 |
0.000 |
0 |
0 |
0 |
0.108 |
19 |
34 |
|
[K]B:404 |
1 |
1 |
216 |
◊ |
[K]B:402 |
x,y,z |
1_555 |
1 |
1 |
216 |
10.4 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.029 |
20 |
35 |
|
[K]D:403 |
1 |
1 |
216 |
◊ |
[K]C:402 |
x,y,z |
1_555 |
1 |
1 |
216 |
9.9 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.027 |
21 |
36 |
|
C |
1 |
1 |
11762 |
◊ |
A |
-x+2,y-1/2,-z |
2_745 |
1 |
1 |
11668 |
4.2 |
0.2 |
0.828 |
0 |
0 |
0 |
0.000 |
|