| ## |
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 |
175 |
49 |
14068 |
◊ |
B |
x,y,z |
1_555 |
171 |
53 |
13887 |
1664.9 |
-10.7 |
0.504 |
13 |
8 |
0 |
0.645 |
2 |
|
B |
177 |
48 |
13887 |
◊ |
A |
x,y,z |
1_555 |
168 |
53 |
14024 |
1655.2 |
-8.9 |
0.624 |
17 |
9 |
0 |
0.645 |
3 |
|
C |
172 |
53 |
14068 |
◊ |
A |
x,y,z |
1_555 |
173 |
50 |
14024 |
1654.6 |
-9.3 |
0.575 |
17 |
6 |
0 |
0.645 |
| Average: |
1658.2 |
-9.6 |
0.568 |
16 |
8 |
0 |
0.645 |
| 2 |
4 |
|
2C |
94 |
31 |
14068 |
x |
B |
x,y,z |
1_555 |
92 |
28 |
13887 |
870.0 |
-6.7 |
0.422 |
6 |
0 |
0 |
0.349 |
5 |
|
5A |
104 |
34 |
14024 |
x |
A |
x,y,z |
1_555 |
98 |
28 |
14024 |
834.9 |
-4.9 |
0.614 |
7 |
0 |
0 |
0.349 |
| Average: |
852.5 |
-5.8 |
0.518 |
7 |
0 |
0 |
0.349 |
| 3 |
6 |
|
5B |
90 |
27 |
13887 |
◊ |
A |
x,y,z |
1_555 |
86 |
27 |
14024 |
850.5 |
-6.4 |
0.554 |
9 |
2 |
0 |
0.093 |
| 4 |
7 |
|
13C |
68 |
27 |
14068 |
◊ |
2B |
x,y,z |
1_555 |
86 |
28 |
13887 |
750.8 |
-5.9 |
0.513 |
9 |
0 |
0 |
0.248 |
| 5 |
8 |
|
13C |
62 |
20 |
14068 |
◊ |
2C |
x,y,z |
1_555 |
64 |
20 |
14068 |
640.7 |
-5.5 |
0.445 |
10 |
0 |
0 |
0.051 |
| 6 |
9 |
|
13R |
66 |
13 |
3471 |
◊ |
2R |
x,y,z |
1_555 |
68 |
13 |
3471 |
591.1 |
-26.9 |
0.844 |
18 |
0 |
0 |
1.000 |
| 7 |
10 |
|
R |
23 |
4 |
3471 |
◊ |
C |
x,y,z |
1_555 |
24 |
11 |
14068 |
230.3 |
-6.5 |
0.618 |
4 |
0 |
0 |
0.068 |
| 8 |
11 |
|
2B |
21 |
8 |
13887 |
◊ |
10B |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
24 |
8 |
13887 |
181.8 |
-4.4 |
0.173 |
0 |
0 |
0 |
0.000 |
| 9 |
12 |
|
16A |
18 |
7 |
14024 |
◊ |
15A |
x-1,y,z |
1_455 |
17 |
7 |
14024 |
158.5 |
-2.4 |
0.331 |
3 |
0 |
0 |
0.000 |
| 10 |
13 |
|
B |
22 |
8 |
13887 |
◊ |
9A |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
13 |
5 |
14024 |
151.6 |
-2.4 |
0.329 |
2 |
0 |
0 |
0.000 |
| 11 |
14 |
|
17C |
15 |
6 |
14068 |
◊ |
11A |
x-1,y,z |
1_455 |
9 |
3 |
14024 |
124.2 |
-2.8 |
0.160 |
0 |
0 |
0 |
0.000 |
| 12 |
15 |
|
2C |
21 |
8 |
14068 |
◊ |
10C |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
19 |
8 |
14068 |
124.1 |
-1.3 |
0.548 |
0 |
0 |
0 |
0.006 |
| 13 |
16 |
|
2C |
16 |
6 |
14068 |
◊ |
10B |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
14 |
5 |
13887 |
122.0 |
-1.1 |
0.528 |
0 |
0 |
0 |
0.000 |
| 14 |
17 |
|
17A |
14 |
6 |
14024 |
◊ |
11A |
x-1,y,z |
1_455 |
13 |
6 |
14024 |
108.6 |
0.2 |
0.745 |
1 |
0 |
0 |
0.000 |
| 15 |
18 |
|
16C |
9 |
4 |
14068 |
◊ |
15A |
x-1,y,z |
1_455 |
8 |
4 |
14024 |
86.8 |
-0.8 |
0.350 |
1 |
0 |
0 |
0.000 |
| 16 |
19 |
|
C |
7 |
2 |
14068 |
◊ |
9B |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
9 |
4 |
13887 |
64.0 |
-0.7 |
0.493 |
1 |
0 |
0 |
0.005 |
| 17 |
20 |
|
13R |
10 |
3 |
3471 |
◊ |
2C |
x,y,z |
1_555 |
7 |
2 |
14068 |
60.3 |
1.2 |
0.866 |
0 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[SO4]A:503 |
4 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
13887 |
57.8 |
-7.1 |
0.830 |
2 |
0 |
0 |
0.296 |
| 19 |
22 |
|
[SO4]A:503 |
4 |
1 |
187 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
14068 |
56.8 |
-7.0 |
0.832 |
2 |
0 |
0 |
0.096 |
| 20 |
23 |
|
[SO4]A:503 |
4 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
14024 |
56.7 |
-6.9 |
0.857 |
2 |
0 |
0 |
0.094 |
| 21 |
24 |
|
B |
8 |
3 |
13887 |
◊ |
9B |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
6 |
4 |
13887 |
53.4 |
0.2 |
0.731 |
0 |
0 |
0 |
0.000 |
| 22 |
25 |
|
[CL]B:502 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
13887 |
51.4 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.212 |
| 23 |
26 |
|
5[CL]B:502 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
14068 |
38.2 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.142 |
| 24 |
27 |
|
14C |
2 |
1 |
14068 |
x |
2C |
x,y,z |
1_555 |
2 |
1 |
14068 |
30.0 |
-1.9 |
0.016 |
0 |
0 |
0 |
0.049 |
| 25 |
28 |
|
13B |
2 |
1 |
13887 |
x |
B |
x,y,z |
1_555 |
1 |
1 |
13887 |
15.7 |
-1.0 |
0.073 |
0 |
0 |
0 |
0.025 |
| 26 |
29 |
|
4A |
2 |
2 |
14024 |
x |
A |
x,y,z |
1_555 |
2 |
2 |
14024 |
13.6 |
-0.6 |
0.246 |
0 |
0 |
0 |
0.005 |
| 27 |
30 |
|
A |
2 |
1 |
14024 |
◊ |
9A |
-y+2/3,x-y+1/3,z+1/3 |
5_555 |
2 |
1 |
14024 |
7.5 |
-0.2 |
0.403 |
0 |
0 |
0 |
0.000 |
| 28 |
31 |
|
R |
1 |
1 |
3471 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
13887 |
4.7 |
-0.1 |
0.486 |
0 |
0 |
0 |
0.000 |
| 29 |
32 |
|
16B |
1 |
1 |
13887 |
◊ |
15A |
x-1,y,z |
1_455 |
1 |
1 |
14024 |
4.2 |
0.0 |
0.531 |
0 |
0 |
0 |
0.000 |
|