| ## |
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 |
|
B |
75 |
22 |
13792 |
◊ |
A |
x,y,z-1 |
1_554 |
75 |
25 |
13869 |
733.6 |
-11.5 |
0.035 |
2 |
0 |
0 |
0.010 |
| 2 |
2 |
|
B |
56 |
17 |
13792 |
◊ |
A |
x,y,z |
1_555 |
59 |
18 |
13869 |
538.4 |
-1.9 |
0.494 |
2 |
0 |
0 |
0.000 |
| 3 |
3 |
|
A |
48 |
14 |
13869 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
50 |
11 |
13792 |
433.3 |
0.5 |
0.636 |
6 |
0 |
0 |
0.000 |
| 4 |
4 |
|
[9TO]B:501 |
26 |
1 |
580 |
f |
B |
x,y,z |
1_555 |
53 |
22 |
13792 |
394.6 |
-2.0 |
0.374 |
1 |
0 |
0 |
0.005 |
5 |
|
[9TO]A:501 |
26 |
1 |
582 |
f |
A |
x,y,z |
1_555 |
52 |
22 |
13869 |
392.5 |
-1.8 |
0.386 |
2 |
0 |
0 |
0.005 |
| Average: |
393.5 |
-1.9 |
0.380 |
2 |
0 |
0 |
0.005 |
| 5 |
6 |
|
B |
38 |
10 |
13792 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
3_546 |
39 |
12 |
13869 |
359.3 |
-2.6 |
0.353 |
4 |
0 |
0 |
0.000 |
| 6 |
7 |
|
B |
36 |
10 |
13792 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
31 |
8 |
13869 |
301.1 |
-1.7 |
0.431 |
3 |
0 |
0 |
0.000 |
| 7 |
8 |
|
B |
29 |
9 |
13792 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
4_446 |
30 |
9 |
13869 |
253.1 |
-1.4 |
0.434 |
1 |
0 |
0 |
0.000 |
| 8 |
9 |
|
A |
21 |
9 |
13869 |
◊ |
A |
-x,-y,z |
2_555 |
21 |
9 |
13869 |
135.5 |
1.4 |
0.768 |
0 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[SO4]A:503 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
17 |
10 |
13869 |
107.1 |
-17.8 |
0.654 |
3 |
0 |
0 |
0.035 |
| 10 |
11 |
|
[SO4]B:504 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
13792 |
105.7 |
-17.1 |
0.691 |
3 |
0 |
0 |
0.035 |
| 11 |
12 |
|
[SO4]A:504 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
13869 |
102.9 |
-13.7 |
0.912 |
3 |
0 |
0 |
0.028 |
| 12 |
13 |
|
[SO4]B:503 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
13792 |
99.9 |
-13.9 |
0.833 |
3 |
0 |
0 |
0.029 |
| 13 |
14 |
|
[SO4]B:502 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
18 |
6 |
13792 |
98.5 |
-13.1 |
0.899 |
3 |
0 |
0 |
0.027 |
| 14 |
15 |
|
[SO4]A:502 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
13869 |
95.8 |
-13.4 |
0.820 |
3 |
0 |
0 |
0.027 |
| 15 |
16 |
|
B |
10 |
4 |
13792 |
◊ |
[9TO]A:501 |
-x+1/2,y-1/2,-z+1 |
3_546 |
6 |
1 |
582 |
81.5 |
-1.3 |
0.341 |
0 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[9TO]B:501 |
3 |
1 |
580 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
9 |
5 |
13869 |
62.7 |
-1.2 |
0.286 |
0 |
0 |
0 |
0.000 |
| 17 |
18 |
|
A |
5 |
3 |
13869 |
x |
A |
x,y,z-1 |
1_554 |
5 |
2 |
13869 |
30.0 |
0.4 |
0.657 |
0 |
0 |
0 |
0.000 |
19 |
|
B |
3 |
2 |
13792 |
x |
B |
x,y,z-1 |
1_554 |
2 |
2 |
13792 |
13.5 |
-0.0 |
0.547 |
0 |
0 |
0 |
0.000 |
| Average: |
21.7 |
0.2 |
0.602 |
0 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[SO4]A:503 |
1 |
1 |
186 |
f |
[SO4]A:502 |
x,y,z |
1_555 |
1 |
1 |
186 |
12.1 |
-2.9 |
0.800 |
0 |
0 |
0 |
0.005 |
| 19 |
21 |
|
[SO4]B:504 |
1 |
1 |
184 |
f |
[SO4]B:503 |
x,y,z |
1_555 |
1 |
1 |
185 |
9.4 |
-2.3 |
0.800 |
0 |
0 |
0 |
0.004 |
| 20 |
22 |
|
B |
2 |
2 |
13792 |
◊ |
B |
-x,-y-1,z |
2_545 |
2 |
2 |
13792 |
3.4 |
0.2 |
0.727 |
0 |
0 |
0 |
0.000 |
|