| ## |
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 |
174 |
37 |
7239 |
◊ |
B |
x,y,z |
1_555 |
205 |
58 |
22103 |
1852.2 |
-16.3 |
0.293 |
8 |
2 |
0 |
0.501 |
2 |
|
F |
153 |
32 |
6774 |
◊ |
E |
x,y,z |
1_555 |
181 |
50 |
20872 |
1539.9 |
-17.2 |
0.205 |
6 |
1 |
0 |
0.501 |
| Average: |
1696.0 |
-16.7 |
0.249 |
7 |
2 |
0 |
0.501 |
| 2 |
3 |
|
B |
161 |
45 |
22103 |
◊ |
A |
x,y,z |
1_555 |
160 |
41 |
20772 |
1519.4 |
-8.3 |
0.455 |
13 |
5 |
0 |
0.274 |
4 |
|
E |
144 |
43 |
20872 |
◊ |
D |
x,y,z |
1_555 |
136 |
39 |
22297 |
1354.8 |
-5.7 |
0.435 |
14 |
4 |
0 |
0.274 |
| Average: |
1437.1 |
-7.0 |
0.445 |
14 |
5 |
0 |
0.274 |
| 3 |
5 |
|
E |
165 |
43 |
20872 |
◊ |
B |
x,y,z |
1_555 |
166 |
34 |
22103 |
1474.9 |
-12.5 |
0.197 |
5 |
0 |
0 |
0.213 |
| 4 |
6 |
|
B |
98 |
28 |
22103 |
◊ |
A |
x-1,y,z |
1_455 |
82 |
20 |
20772 |
786.7 |
-0.0 |
0.730 |
1 |
3 |
0 |
0.000 |
| 5 |
7 |
|
D |
83 |
30 |
22297 |
◊ |
A |
x-1,y-1,z-1 |
1_444 |
68 |
22 |
20772 |
624.1 |
-2.1 |
0.572 |
3 |
2 |
0 |
0.000 |
| 6 |
8 |
|
F |
61 |
17 |
6774 |
◊ |
D |
x,y,z |
1_555 |
68 |
19 |
22297 |
558.0 |
-6.7 |
0.324 |
3 |
0 |
0 |
0.122 |
9 |
|
C |
56 |
15 |
7239 |
◊ |
A |
x,y,z |
1_555 |
66 |
19 |
20772 |
531.7 |
-7.4 |
0.247 |
2 |
0 |
0 |
0.122 |
| Average: |
544.9 |
-7.1 |
0.285 |
3 |
0 |
0 |
0.122 |
| 7 |
10 |
|
D |
52 |
11 |
22297 |
x |
D |
x-1,y,z |
1_455 |
68 |
20 |
22297 |
528.4 |
-2.3 |
0.483 |
0 |
0 |
0 |
0.000 |
| 8 |
11 |
|
[ATP]D:501 |
30 |
1 |
638 |
f |
D |
x,y,z |
1_555 |
75 |
27 |
22297 |
501.3 |
-3.0 |
0.544 |
6 |
0 |
0 |
0.100 |
12 |
|
[ATP]A:501 |
30 |
1 |
637 |
f |
A |
x,y,z |
1_555 |
78 |
26 |
20772 |
490.4 |
-3.7 |
0.541 |
3 |
0 |
0 |
0.100 |
| Average: |
495.9 |
-3.4 |
0.543 |
5 |
0 |
0 |
0.100 |
| 9 |
13 |
|
D |
42 |
13 |
22297 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
40 |
9 |
22103 |
364.7 |
-2.8 |
0.379 |
1 |
1 |
0 |
0.000 |
| 10 |
14 |
|
C |
29 |
7 |
7239 |
◊ |
D |
x,y,z |
1_555 |
36 |
14 |
22297 |
329.5 |
-2.6 |
0.396 |
2 |
0 |
0 |
0.020 |
| 11 |
15 |
|
D |
34 |
9 |
22297 |
◊ |
E |
x,y-1,z |
1_545 |
38 |
9 |
20872 |
308.4 |
-2.5 |
0.358 |
0 |
0 |
0 |
0.000 |
| 12 |
16 |
|
F |
26 |
5 |
6774 |
◊ |
A |
x,y,z |
1_555 |
28 |
10 |
20772 |
213.3 |
-2.2 |
0.490 |
2 |
0 |
0 |
0.018 |
| 13 |
17 |
|
[SO4]B:501 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
22103 |
111.5 |
-18.4 |
0.751 |
2 |
0 |
0 |
0.356 |
| 14 |
18 |
|
[SO4]E:501 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
17 |
7 |
20872 |
110.9 |
-19.1 |
0.589 |
2 |
0 |
0 |
0.499 |
| 15 |
19 |
|
[SO4]B:502 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
22103 |
108.8 |
-14.8 |
0.808 |
1 |
0 |
0 |
0.281 |
| 16 |
20 |
|
D |
8 |
3 |
22297 |
◊ |
E |
x-1,y,z |
1_455 |
11 |
4 |
20872 |
103.4 |
0.5 |
0.699 |
0 |
0 |
0 |
0.000 |
| 17 |
21 |
|
B |
8 |
4 |
22103 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
22297 |
44.0 |
-1.0 |
0.290 |
0 |
0 |
0 |
0.006 |
| 18 |
22 |
|
E |
2 |
2 |
20872 |
x |
E |
x-1,y,z |
1_455 |
7 |
2 |
20872 |
41.3 |
-0.0 |
0.525 |
0 |
0 |
0 |
0.000 |
| 19 |
23 |
|
E |
5 |
2 |
20872 |
◊ |
A |
x,y,z-1 |
1_554 |
3 |
1 |
20772 |
40.5 |
-0.4 |
0.447 |
0 |
0 |
0 |
0.000 |
| 20 |
24 |
|
E |
4 |
3 |
20872 |
◊ |
A |
x-1,y,z-1 |
1_454 |
5 |
2 |
20772 |
29.2 |
0.1 |
0.636 |
0 |
0 |
0 |
0.000 |
| 21 |
25 |
|
F |
3 |
2 |
6774 |
◊ |
E |
x,y-1,z |
1_545 |
5 |
2 |
20872 |
23.0 |
0.4 |
0.725 |
0 |
0 |
0 |
0.000 |
| 22 |
26 |
|
B |
1 |
1 |
22103 |
◊ |
F |
x-1,y,z |
1_455 |
2 |
1 |
6774 |
19.3 |
0.4 |
0.573 |
0 |
0 |
0 |
0.000 |
| 23 |
27 |
|
D |
4 |
2 |
22297 |
◊ |
A |
x,y,z-1 |
1_554 |
1 |
1 |
20772 |
17.7 |
0.6 |
0.706 |
0 |
0 |
0 |
0.000 |
| 24 |
28 |
|
D |
4 |
1 |
22297 |
◊ |
A |
x-1,y,z-1 |
1_454 |
1 |
1 |
20772 |
16.0 |
0.1 |
0.661 |
0 |
0 |
0 |
0.000 |
| 25 |
29 |
|
[ATP]D:501 |
2 |
1 |
638 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
20872 |
14.8 |
0.4 |
0.604 |
0 |
0 |
0 |
0.000 |
30 |
|
[ATP]A:501 |
1 |
1 |
637 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
22103 |
10.2 |
0.2 |
0.627 |
0 |
0 |
0 |
0.000 |
| Average: |
12.5 |
0.3 |
0.616 |
0 |
0 |
0 |
0.000 |
| 26 |
31 |
|
D |
2 |
1 |
22297 |
◊ |
B |
x,y-1,z-1 |
1_544 |
1 |
1 |
22103 |
12.6 |
0.3 |
0.800 |
0 |
0 |
0 |
0.000 |
| 27 |
32 |
|
C |
3 |
1 |
7239 |
◊ |
F |
x-1,y,z |
1_455 |
2 |
2 |
6774 |
7.2 |
0.3 |
0.751 |
0 |
0 |
0 |
0.000 |
| 28 |
33 |
|
E |
2 |
1 |
20872 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
20772 |
3.5 |
-0.0 |
0.621 |
0 |
0 |
0 |
0.000 |
|