| ## |
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 |
42 |
14 |
6458 |
x |
A |
x-1,y,z |
1_455 |
42 |
14 |
6458 |
355.0 |
1.2 |
0.586 |
5 |
0 |
0 |
0.000 |
2 |
|
B |
43 |
15 |
6552 |
x |
B |
x-1,y,z |
1_455 |
38 |
12 |
6552 |
354.1 |
2.6 |
0.707 |
5 |
0 |
0 |
0.000 |
| Average: |
354.5 |
1.9 |
0.647 |
5 |
0 |
0 |
0.000 |
| 2 |
3 |
|
B |
40 |
10 |
6552 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
43 |
14 |
6458 |
331.7 |
-0.0 |
0.437 |
4 |
0 |
0 |
0.000 |
| 3 |
4 |
|
B |
37 |
9 |
6552 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
36 |
10 |
6458 |
298.4 |
-0.8 |
0.378 |
3 |
0 |
0 |
0.000 |
| 4 |
5 |
|
B |
27 |
8 |
6552 |
◊ |
A |
x,y,z |
1_555 |
31 |
9 |
6458 |
258.5 |
1.5 |
0.664 |
4 |
0 |
0 |
0.002 |
| 5 |
6 |
|
B |
22 |
7 |
6552 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
22 |
7 |
6458 |
201.0 |
-2.7 |
0.166 |
1 |
0 |
0 |
0.000 |
| 6 |
7 |
|
A |
14 |
4 |
6458 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
22 |
5 |
6458 |
169.6 |
2.1 |
0.749 |
4 |
0 |
0 |
0.000 |
| 7 |
8 |
|
[CL]B:204 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
6552 |
73.5 |
-10.2 |
0.000 |
0 |
0 |
0 |
0.062 |
| 8 |
9 |
|
B |
8 |
2 |
6552 |
x |
B |
-x,y-1/2,-z |
2_545 |
5 |
1 |
6552 |
64.9 |
1.6 |
0.843 |
0 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[CL]A:211 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
6458 |
64.7 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.052 |
| 10 |
11 |
|
[CL]B:208 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
6552 |
62.9 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.058 |
| 11 |
12 |
|
[CL]A:201 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
6458 |
62.5 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.075 |
| 12 |
13 |
|
[CL]A:203 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
6458 |
61.8 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.052 |
| 13 |
14 |
|
[CL]B:202 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
6552 |
59.7 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.052 |
| 14 |
15 |
|
[CL]B:201 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
5 |
6552 |
58.6 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.134 |
16 |
|
[CL]A:204 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
5 |
5 |
6458 |
57.8 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.134 |
| Average: |
58.2 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.134 |
| 15 |
17 |
|
[CL]B:203 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
6552 |
57.7 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.047 |
| 16 |
18 |
|
[CL]B:206 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
6552 |
56.8 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.048 |
| 17 |
19 |
|
[CL]A:209 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
6458 |
56.0 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.050 |
| 18 |
20 |
|
[CL]A:206 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
6458 |
54.7 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.046 |
| 19 |
21 |
|
[CL]A:208 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
6552 |
54.6 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.046 |
| 20 |
22 |
|
A |
6 |
4 |
6458 |
◊ |
B |
x-1,y,z |
1_455 |
7 |
4 |
6552 |
52.4 |
-0.1 |
0.375 |
0 |
0 |
0 |
0.000 |
| 21 |
23 |
|
[CL]B:207 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
3 |
6552 |
52.3 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.041 |
| 22 |
24 |
|
[CL]A:207 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
6458 |
51.1 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.043 |
| 23 |
25 |
|
B |
8 |
4 |
6552 |
f |
[CL]A:210 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
125 |
50.6 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.031 |
| 24 |
26 |
|
[CL]A:205 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
2 |
6552 |
46.8 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.034 |
| 25 |
27 |
|
[CL]A:205 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
6458 |
44.9 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.034 |
| 26 |
28 |
|
[CL]A:208 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
6458 |
43.4 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.031 |
| 27 |
29 |
|
[CL]A:202 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
6458 |
43.1 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.035 |
| 28 |
30 |
|
[CL]A:210 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
6458 |
40.7 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| 29 |
31 |
|
[CL]B:203 |
1 |
1 |
125 |
◊ |
B |
x-1,y,z |
1_455 |
6 |
3 |
6552 |
39.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 30 |
32 |
|
A |
7 |
3 |
6458 |
◊ |
[CL]A:202 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
36.4 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 31 |
33 |
|
[CL]B:205 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
6458 |
36.3 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 32 |
34 |
|
[CL]B:205 |
1 |
1 |
125 |
f |
B |
x-1,y,z |
1_455 |
4 |
1 |
6552 |
35.5 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.026 |
| 33 |
35 |
|
[CL]B:205 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
6552 |
30.6 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 34 |
36 |
|
B |
9 |
3 |
6552 |
◊ |
[CL]A:209 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
125 |
30.2 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 35 |
37 |
|
[CL]A:207 |
1 |
1 |
125 |
◊ |
[CL]A:202 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
24.3 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| 36 |
38 |
|
[CL]A:207 |
1 |
1 |
125 |
◊ |
A |
x-1,y,z |
1_455 |
9 |
5 |
6458 |
21.2 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 37 |
39 |
|
B |
4 |
1 |
6552 |
◊ |
[CL]B:208 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
19.7 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 38 |
40 |
|
A |
2 |
1 |
6458 |
◊ |
[CL]A:206 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
17.0 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 39 |
41 |
|
[CL]B:201 |
1 |
1 |
125 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
6552 |
16.9 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.000 |
42 |
|
A |
3 |
1 |
6458 |
◊ |
[CL]A:204 |
x-1,y,z |
1_455 |
1 |
1 |
125 |
12.2 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
14.5 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 40 |
43 |
|
B |
4 |
2 |
6552 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
6458 |
15.5 |
0.5 |
0.655 |
0 |
0 |
0 |
0.000 |
| 41 |
44 |
|
[CL]B:204 |
1 |
1 |
125 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
2 |
6458 |
14.8 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 42 |
45 |
|
[CL]B:202 |
1 |
1 |
125 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
2 |
6458 |
14.3 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.000 |
| 43 |
46 |
|
[CL]B:205 |
1 |
1 |
125 |
◊ |
[CL]A:205 |
x,y,z |
1_555 |
1 |
1 |
125 |
13.2 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 44 |
47 |
|
A |
2 |
1 |
6458 |
◊ |
[CL]A:203 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
125 |
12.1 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 45 |
48 |
|
A |
3 |
1 |
6458 |
◊ |
[CL]A:209 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
125 |
9.1 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| 46 |
49 |
|
[CL]B:208 |
1 |
1 |
125 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
6458 |
7.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 47 |
50 |
|
B |
3 |
1 |
6552 |
◊ |
[CL]A:202 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
125 |
6.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
51 |
|
B |
1 |
1 |
6552 |
◊ |
[CL]A:207 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
125 |
0.8 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
3.6 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 48 |
52 |
|
A |
2 |
1 |
6458 |
◊ |
B |
x-1,y+1,z |
1_465 |
1 |
1 |
6552 |
2.1 |
0.0 |
0.609 |
0 |
0 |
0 |
0.000 |
|