## |
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 |
61 |
16 |
3982 |
◊ |
C |
x,y,z |
1_555 |
61 |
16 |
3775 |
566.8 |
0.0 |
0.454 |
13 |
4 |
0 |
0.000 |
2 |
|
B |
54 |
15 |
3884 |
◊ |
A |
x,y,z |
1_555 |
53 |
16 |
3792 |
536.9 |
-1.1 |
0.370 |
11 |
4 |
0 |
0.000 |
3 |
|
E |
56 |
16 |
3909 |
◊ |
B |
-x,-y,z |
10_444 |
59 |
16 |
3884 |
510.3 |
-1.1 |
0.357 |
12 |
3 |
0 |
0.000 |
4 |
|
E |
58 |
16 |
3909 |
◊ |
A |
x,y,z |
1_555 |
57 |
16 |
3792 |
501.7 |
-1.5 |
0.321 |
10 |
3 |
0 |
0.000 |
5 |
|
F |
51 |
15 |
3879 |
◊ |
C |
x,y,z |
1_555 |
55 |
15 |
3775 |
482.0 |
-1.3 |
0.362 |
10 |
3 |
0 |
0.000 |
6 |
|
F |
54 |
16 |
3879 |
◊ |
D |
-x,-y,z |
10_444 |
49 |
14 |
3982 |
470.9 |
-2.5 |
0.288 |
9 |
3 |
0 |
0.000 |
Average: |
511.4 |
-1.2 |
0.359 |
11 |
3 |
0 |
0.000 |
2 |
7 |
|
E |
54 |
18 |
3909 |
◊ |
E |
x,-y+1/2,-z+1/4 |
6_555 |
54 |
18 |
3909 |
533.5 |
-7.2 |
0.045 |
6 |
0 |
0 |
0.386 |
3 |
8 |
|
D |
46 |
14 |
3982 |
◊ |
D |
-x+1/2,y,-z+3/4 |
5_555 |
46 |
14 |
3982 |
432.3 |
-4.0 |
0.180 |
2 |
0 |
0 |
0.000 |
4 |
9 |
|
A |
21 |
5 |
3792 |
◊ |
F |
-y+1/2,x,z-1/4 |
11_544 |
20 |
5 |
3879 |
187.2 |
-2.5 |
0.191 |
1 |
0 |
0 |
0.000 |
5 |
10 |
|
B |
20 |
5 |
3884 |
◊ |
F |
-y+1/2,x,z-1/4 |
11_544 |
19 |
8 |
3879 |
155.9 |
-1.8 |
0.241 |
0 |
0 |
0 |
0.000 |
6 |
11 |
|
E |
11 |
2 |
3909 |
◊ |
D |
-x,-y,z |
10_444 |
10 |
2 |
3982 |
106.2 |
0.9 |
0.666 |
2 |
0 |
0 |
0.000 |
12 |
|
C |
11 |
2 |
3775 |
◊ |
B |
x,y,z |
1_555 |
10 |
2 |
3884 |
105.7 |
0.9 |
0.675 |
2 |
0 |
0 |
0.000 |
13 |
|
F |
10 |
2 |
3879 |
◊ |
A |
x,y,z |
1_555 |
10 |
2 |
3792 |
105.6 |
0.9 |
0.669 |
2 |
0 |
0 |
0.000 |
Average: |
105.8 |
0.9 |
0.670 |
2 |
0 |
0 |
0.000 |
7 |
14 |
|
F |
8 |
3 |
3879 |
◊ |
E |
x,y,z |
1_555 |
8 |
3 |
3909 |
88.4 |
1.6 |
0.791 |
1 |
0 |
0 |
0.000 |
15 |
|
C |
8 |
3 |
3775 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
3792 |
85.0 |
1.6 |
0.789 |
1 |
0 |
0 |
0.000 |
16 |
|
D |
9 |
3 |
3982 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
3884 |
82.0 |
1.7 |
0.798 |
1 |
0 |
0 |
0.000 |
Average: |
85.1 |
1.6 |
0.793 |
1 |
0 |
0 |
0.000 |
8 |
17 |
|
A |
13 |
6 |
3792 |
◊ |
C |
-y+1/2,x,z-1/4 |
11_544 |
8 |
3 |
3775 |
76.7 |
-0.0 |
0.505 |
1 |
0 |
0 |
0.000 |
9 |
18 |
|
[CL]F:101 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
15 |
6 |
3879 |
75.2 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.614 |
19 |
|
[CL]A:101 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
3792 |
68.0 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.614 |
20 |
|
[CL]D:101 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
14 |
6 |
3982 |
67.0 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.614 |
21 |
|
[CL]B:101 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
3884 |
66.5 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.614 |
22 |
|
[CL]E:101 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
16 |
6 |
3909 |
64.4 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.614 |
23 |
|
[CL]C:101 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
3775 |
62.8 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.614 |
Average: |
67.3 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.614 |
10 |
24 |
|
C |
10 |
1 |
3775 |
◊ |
C |
-x+1/2,y,-z+3/4 |
5_555 |
10 |
1 |
3775 |
61.0 |
-1.7 |
0.196 |
0 |
0 |
0 |
0.000 |
11 |
25 |
|
B |
9 |
2 |
3884 |
◊ |
E |
-x,y-1/2,-z+1/4 |
13_444 |
9 |
1 |
3909 |
57.1 |
-0.7 |
0.338 |
0 |
0 |
0 |
0.000 |
12 |
26 |
|
[CL]A:102 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
3792 |
56.3 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.043 |
27 |
|
[CL]F:102 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
8 |
3 |
3879 |
54.7 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.043 |
28 |
|
[CL]B:102 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
3884 |
54.0 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.043 |
Average: |
55.0 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.043 |
13 |
29 |
|
[CL]E:101 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
3879 |
22.7 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
30 |
|
[CL]C:101 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
3792 |
21.0 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
31 |
|
[CL]F:101 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
3909 |
19.2 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
32 |
|
[CL]D:101 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
3884 |
15.5 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
|
[CL]B:101 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
3982 |
14.4 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
34 |
|
[CL]A:101 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
3775 |
13.1 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
17.6 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
14 |
35 |
|
[CL]B:101 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
3775 |
16.2 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
|
[CL]C:101 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
3884 |
15.2 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
37 |
|
[CL]A:101 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
3879 |
15.0 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
38 |
|
[CL]E:101 |
1 |
1 |
125 |
◊ |
D |
-x,-y,z |
10_444 |
1 |
1 |
3982 |
15.0 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
39 |
|
[CL]D:101 |
1 |
1 |
125 |
◊ |
E |
-x,-y,z |
10_444 |
1 |
1 |
3909 |
14.6 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
40 |
|
[CL]F:101 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
3792 |
10.0 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
14.3 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
15 |
41 |
|
[CL]B:102 |
1 |
1 |
125 |
◊ |
[CL]A:102 |
x,y,z |
1_555 |
1 |
1 |
125 |
11.5 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.000 |
16 |
42 |
|
[CL]A:101 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
3909 |
10.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
43 |
|
[CL]C:101 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
3982 |
10.1 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
44 |
|
[CL]E:101 |
1 |
1 |
125 |
◊ |
B |
-x,-y,z |
10_444 |
1 |
1 |
3884 |
9.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
45 |
|
[CL]D:101 |
1 |
1 |
125 |
◊ |
F |
-x,-y,z |
10_444 |
1 |
1 |
3879 |
9.0 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
46 |
|
[CL]B:101 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
3792 |
7.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
47 |
|
[CL]F:101 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
3775 |
1.5 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
8.0 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
17 |
48 |
|
[CL]A:102 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
3884 |
8.8 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
49 |
|
[CL]F:102 |
1 |
1 |
125 |
◊ |
D |
-x,-y,z |
10_444 |
2 |
1 |
3982 |
6.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
50 |
|
[CL]B:102 |
1 |
1 |
125 |
◊ |
E |
-x,-y,z |
10_444 |
2 |
1 |
3909 |
4.1 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
6.5 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
|