| ## |
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 |
|
U |
83 |
18 |
4103 |
◊ |
T |
x,y,z |
1_555 |
83 |
18 |
4108 |
820.1 |
-11.8 |
0.687 |
56 |
0 |
0 |
0.664 |
| 2 |
2 |
|
P |
69 |
21 |
6890 |
◊ |
B |
x,y,z |
1_555 |
72 |
20 |
6972 |
711.9 |
-5.0 |
0.356 |
10 |
2 |
0 |
0.066 |
| 3 |
3 |
|
T |
50 |
9 |
4108 |
◊ |
B |
x,y,z |
1_555 |
44 |
15 |
6972 |
449.3 |
-7.6 |
0.490 |
14 |
0 |
0 |
0.258 |
4 |
|
P |
41 |
15 |
6890 |
◊ |
U |
-z+3/2,-x+1/2,y+1/2 |
19_655 |
47 |
9 |
4103 |
447.2 |
-9.1 |
0.383 |
13 |
0 |
0 |
0.258 |
| Average: |
448.3 |
-8.3 |
0.437 |
14 |
0 |
0 |
0.258 |
| 4 |
5 |
|
P |
34 |
10 |
6890 |
◊ |
T |
-z+3/2,-x+1/2,y+1/2 |
19_655 |
36 |
8 |
4108 |
344.8 |
-2.8 |
0.538 |
11 |
0 |
0 |
0.139 |
6 |
|
U |
33 |
8 |
4103 |
◊ |
B |
x,y,z |
1_555 |
31 |
10 |
6972 |
338.9 |
-2.2 |
0.548 |
9 |
0 |
0 |
0.139 |
| Average: |
341.8 |
-2.5 |
0.543 |
10 |
0 |
0 |
0.139 |
| 5 |
7 |
|
[SO4]P:865 |
5 |
1 |
187 |
f |
P |
x,y,z |
1_555 |
23 |
9 |
6890 |
117.7 |
-18.9 |
0.583 |
0 |
0 |
0 |
0.201 |
| 6 |
8 |
|
[SO4]P:335 |
5 |
1 |
186 |
f |
P |
x,y,z |
1_555 |
19 |
10 |
6890 |
114.1 |
-17.4 |
0.715 |
3 |
0 |
0 |
0.199 |
| 7 |
9 |
|
[SO4]B:835 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
23 |
9 |
6972 |
111.8 |
-17.8 |
0.614 |
0 |
0 |
0 |
0.398 |
| 8 |
10 |
|
T |
13 |
1 |
4108 |
x |
T |
z-1/2,-x+1/2,-y+3/2 |
18_456 |
14 |
1 |
4108 |
108.4 |
3.5 |
0.890 |
0 |
0 |
0 |
0.000 |
11 |
|
U |
13 |
1 |
4103 |
x |
U |
z-1/2,-x+1/2,-y+3/2 |
18_456 |
12 |
1 |
4103 |
107.5 |
3.9 |
0.898 |
1 |
0 |
0 |
0.000 |
| Average: |
107.9 |
3.7 |
0.894 |
1 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[SO4]P:435 |
5 |
1 |
186 |
f |
P |
x,y,z |
1_555 |
15 |
6 |
6890 |
87.8 |
-12.4 |
0.678 |
2 |
0 |
0 |
0.142 |
| 10 |
13 |
|
[SO4]P:274 |
5 |
1 |
186 |
f |
P |
x,y,z |
1_555 |
13 |
4 |
6890 |
77.1 |
-10.5 |
0.845 |
5 |
0 |
0 |
0.135 |
| 11 |
14 |
|
[SO4]P:965 |
5 |
1 |
186 |
f |
P |
x,y,z |
1_555 |
11 |
4 |
6890 |
70.4 |
-10.0 |
0.692 |
3 |
0 |
0 |
0.121 |
| 12 |
15 |
|
[SO4]B:936 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
6972 |
70.1 |
-9.5 |
0.837 |
2 |
0 |
0 |
0.231 |
| 13 |
16 |
|
[SO4]P:274 |
4 |
1 |
186 |
◊ |
U |
-z+3/2,-x+1/2,y+1/2 |
19_655 |
8 |
4 |
4103 |
53.5 |
-5.6 |
0.875 |
2 |
0 |
0 |
0.064 |
| 14 |
17 |
|
[SO4]B:936 |
4 |
1 |
186 |
◊ |
T |
x,y,z |
1_555 |
8 |
4 |
4108 |
52.6 |
-5.6 |
0.885 |
2 |
0 |
0 |
0.121 |
| 15 |
18 |
|
[SO4]B:836 |
4 |
1 |
185 |
f |
U |
x,y,z |
1_555 |
6 |
3 |
4103 |
43.5 |
-4.5 |
0.870 |
2 |
0 |
0 |
0.121 |
| 16 |
19 |
|
U |
5 |
1 |
4103 |
◊ |
T |
z-1/2,-x+1/2,-y+3/2 |
18_456 |
5 |
1 |
4108 |
43.0 |
-0.4 |
0.541 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
[SO4]P:273 |
5 |
1 |
185 |
f |
T |
-z+3/2,-x+1/2,y+1/2 |
19_655 |
6 |
3 |
4108 |
42.8 |
-4.6 |
0.873 |
1 |
0 |
0 |
0.100 |
| 18 |
21 |
|
[SO4]B:836 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
6972 |
42.8 |
-3.6 |
0.965 |
0 |
0 |
0 |
0.081 |
| 19 |
22 |
|
[SO4]P:273 |
4 |
1 |
185 |
◊ |
P |
x,y,z |
1_555 |
5 |
3 |
6890 |
42.0 |
-3.6 |
0.934 |
1 |
0 |
0 |
0.043 |
| 20 |
23 |
|
T |
5 |
1 |
4108 |
◊ |
U |
z-1/2,-x+1/2,-y+3/2 |
18_456 |
5 |
1 |
4103 |
29.9 |
-0.7 |
0.508 |
0 |
0 |
0 |
0.000 |
| 21 |
24 |
|
[SO4]B:836 |
4 |
1 |
185 |
◊ |
T |
x,y,z |
1_555 |
3 |
3 |
4108 |
29.8 |
-4.3 |
0.587 |
0 |
0 |
0 |
0.077 |
| 22 |
25 |
|
[SO4]P:273 |
4 |
1 |
185 |
◊ |
U |
-z+3/2,-x+1/2,y+1/2 |
19_655 |
3 |
3 |
4103 |
27.9 |
-3.9 |
0.602 |
0 |
0 |
0 |
0.071 |
| 23 |
26 |
|
[SO4]P:274 |
2 |
1 |
186 |
◊ |
T |
-z+3/2,-x+1/2,y+1/2 |
19_655 |
2 |
2 |
4108 |
13.5 |
-2.4 |
0.521 |
0 |
0 |
0 |
0.025 |
| 24 |
27 |
|
[SO4]B:936 |
3 |
1 |
186 |
◊ |
U |
x,y,z |
1_555 |
3 |
3 |
4103 |
7.8 |
-1.4 |
0.630 |
0 |
0 |
0 |
0.031 |
| 25 |
28 |
|
U |
2 |
1 |
4103 |
◊ |
B |
z-1/2,-x+1/2,-y+3/2 |
18_456 |
1 |
1 |
6972 |
5.6 |
0.2 |
0.623 |
0 |
0 |
0 |
0.000 |
29 |
|
T |
2 |
1 |
4108 |
◊ |
P |
-z+1,x,-y+1 |
8_656 |
1 |
1 |
6890 |
4.6 |
0.1 |
0.585 |
0 |
0 |
0 |
0.000 |
| Average: |
5.1 |
0.1 |
0.604 |
0 |
0 |
0 |
0.000 |
| 26 |
30 |
|
[SO4]P:965 |
1 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
6972 |
3.1 |
-0.3 |
0.862 |
0 |
0 |
0 |
0.002 |
|