| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
317 |
90 |
18894 |
◊ |
A |
x,y,z |
1_555 |
342 |
89 |
18780 |
3085.2 |
-12.0 |
0.394 |
52 |
21 |
0 |
0.243 |
2 |
|
B |
71 |
22 |
18894 |
◊ |
A |
x-1/2,-y+1/2,-z |
3_455 |
73 |
21 |
18780 |
636.6 |
-0.4 |
0.537 |
6 |
0 |
0 |
0.000 |
3 |
|
A |
46 |
9 |
18780 |
x |
A |
x-1/2,-y+3/2,-z |
3_465 |
40 |
11 |
18780 |
385.7 |
1.6 |
0.705 |
6 |
4 |
0 |
0.000 |
4 |
|
[ATP]A:400 |
30 |
1 |
618 |
f |
A |
x,y,z |
1_555 |
53 |
24 |
18780 |
373.3 |
-2.0 |
0.539 |
6 |
0 |
0 |
0.029 |
5 |
|
[ATP]B:400 |
31 |
1 |
610 |
f |
B |
x,y,z |
1_555 |
56 |
27 |
18894 |
361.0 |
-1.4 |
0.566 |
7 |
0 |
0 |
0.029 |
6 |
|
A |
32 |
8 |
18780 |
◊ |
B |
x-1/2,-y+1/2,-z |
3_455 |
34 |
7 |
18894 |
271.2 |
-0.6 |
0.537 |
3 |
0 |
0 |
0.000 |
7 |
|
B |
28 |
9 |
18894 |
◊ |
A |
x-1/2,-y+3/2,-z |
3_465 |
28 |
7 |
18780 |
232.2 |
-1.6 |
0.381 |
1 |
3 |
0 |
0.000 |
8 |
|
B |
27 |
6 |
18894 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
4_645 |
24 |
8 |
18780 |
205.2 |
-0.8 |
0.440 |
1 |
1 |
0 |
0.000 |
9 |
|
A |
16 |
4 |
18780 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
15 |
4 |
18894 |
148.9 |
-1.5 |
0.363 |
0 |
0 |
0 |
0.000 |
10 |
|
A |
17 |
7 |
18780 |
x |
A |
x-1/2,-y+1/2,-z |
3_455 |
14 |
3 |
18780 |
145.4 |
0.2 |
0.586 |
3 |
0 |
0 |
0.000 |
11 |
|
[GOL]A:405 |
6 |
1 |
224 |
f |
A |
x,y,z |
1_555 |
28 |
11 |
18780 |
141.6 |
-0.0 |
0.531 |
4 |
0 |
0 |
0.011 |
12 |
|
[GOL]B:403 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
26 |
11 |
18894 |
130.2 |
-0.3 |
0.542 |
5 |
0 |
0 |
0.016 |
13 |
|
[GOL]B:404 |
6 |
1 |
222 |
◊ |
B |
x,y,z |
1_555 |
19 |
10 |
18894 |
123.0 |
0.0 |
0.612 |
7 |
0 |
0 |
0.020 |
14 |
|
[GOL]A:404 |
6 |
1 |
222 |
◊ |
A |
x,y,z |
1_555 |
22 |
11 |
18780 |
121.7 |
-0.2 |
0.548 |
5 |
0 |
0 |
0.016 |
15 |
|
[GOL]A:401 |
6 |
1 |
222 |
◊ |
A |
x,y,z |
1_555 |
21 |
11 |
18780 |
116.4 |
0.0 |
0.613 |
6 |
0 |
0 |
0.017 |
16 |
|
[ATP]B:400 |
13 |
1 |
610 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
18780 |
114.3 |
-3.2 |
0.318 |
1 |
0 |
0 |
0.024 |
17 |
|
B |
12 |
3 |
18894 |
x |
B |
x-1/2,-y+1/2,-z |
3_455 |
13 |
4 |
18894 |
97.9 |
-0.7 |
0.441 |
0 |
0 |
0 |
0.000 |
18 |
|
[NA]A:406 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
18780 |
80.2 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.076 |
19 |
|
[SO4]A:402 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
18780 |
73.6 |
-10.4 |
0.698 |
4 |
0 |
0 |
0.077 |
20 |
|
[SO4]B:402 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
18894 |
69.4 |
-9.6 |
0.717 |
6 |
0 |
0 |
0.078 |
21 |
|
[NA]B:405 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
8 |
18780 |
60.6 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.071 |
22 |
|
B |
6 |
2 |
18894 |
f |
[SO4]A:403 |
x-1/2,-y+3/2,-z |
3_465 |
4 |
1 |
188 |
57.5 |
-6.5 |
0.922 |
2 |
0 |
0 |
0.047 |
23 |
|
[SO4]A:402 |
5 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
18894 |
57.3 |
-6.6 |
0.891 |
3 |
0 |
0 |
0.051 |
24 |
|
[SO4]B:402 |
5 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
18780 |
52.2 |
-5.8 |
0.874 |
3 |
0 |
0 |
0.046 |
25 |
|
[SO4]A:403 |
4 |
1 |
188 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
18780 |
44.6 |
-4.2 |
0.935 |
0 |
0 |
0 |
0.000 |
26 |
|
[MG]B:401 |
1 |
1 |
98 |
f |
[ATP]B:400 |
x,y,z |
1_555 |
5 |
1 |
610 |
34.2 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.034 |
27 |
|
[SO4]A:402 |
3 |
1 |
187 |
f |
[GOL]B:404 |
x,y,z |
1_555 |
5 |
1 |
222 |
33.9 |
-4.2 |
0.645 |
0 |
0 |
0 |
0.026 |
28 |
|
[GOL]A:404 |
3 |
1 |
222 |
f |
[GOL]A:401 |
x,y,z |
1_555 |
2 |
1 |
222 |
31.0 |
-0.5 |
0.412 |
0 |
0 |
0 |
0.003 |
29 |
|
[MG]B:401 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
18894 |
30.8 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.024 |
30 |
|
[SO4]B:402 |
3 |
1 |
185 |
f |
[GOL]A:401 |
x,y,z |
1_555 |
5 |
1 |
222 |
29.5 |
-3.5 |
0.645 |
0 |
0 |
0 |
0.022 |
31 |
|
[GOL]A:404 |
2 |
1 |
222 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
18894 |
21.0 |
-0.2 |
0.273 |
0 |
0 |
0 |
0.001 |
32 |
|
[SO4]B:402 |
3 |
1 |
185 |
f |
[GOL]A:404 |
x,y,z |
1_555 |
2 |
1 |
222 |
20.2 |
-2.6 |
0.643 |
0 |
0 |
0 |
0.016 |
33 |
|
[MG]B:401 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
18780 |
18.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.011 |
34 |
|
[NA]B:405 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
18894 |
15.0 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.012 |
35 |
|
[GOL]B:404 |
2 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
18780 |
7.6 |
0.0 |
0.564 |
0 |
0 |
0 |
0.000 |
36 |
|
[GOL]A:401 |
1 |
1 |
222 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
18894 |
1.8 |
-0.0 |
0.478 |
0 |
0 |
0 |
0.000 |
|