## |
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 |
157 |
38 |
8820 |
◊ |
A |
x,y,z |
1_555 |
159 |
38 |
8905 |
1430.4 |
-15.4 |
0.188 |
16 |
20 |
0 |
0.277 |
2 |
2 |
|
A |
47 |
16 |
8905 |
◊ |
A |
-x+1,y,-z+5/2 |
3_657 |
47 |
16 |
8905 |
470.5 |
-3.8 |
0.384 |
2 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
52 |
14 |
8905 |
◊ |
A |
x,-y+1,-z+2 |
4_567 |
52 |
14 |
8905 |
441.5 |
2.5 |
0.866 |
10 |
0 |
0 |
0.000 |
4 |
4 |
|
B |
37 |
15 |
8820 |
◊ |
B |
-x,y,-z+5/2 |
3_557 |
37 |
15 |
8820 |
368.8 |
-6.7 |
0.101 |
4 |
0 |
0 |
0.000 |
5 |
5 |
|
B |
34 |
11 |
8820 |
◊ |
B |
x,-y,-z+2 |
4_557 |
34 |
11 |
8820 |
324.5 |
2.6 |
0.880 |
10 |
4 |
0 |
0.000 |
6 |
6 |
|
[6MS]B:301 |
20 |
1 |
511 |
f |
B |
x,y,z |
1_555 |
37 |
15 |
8820 |
297.1 |
-0.8 |
0.577 |
11 |
0 |
0 |
0.132 |
7 |
|
[6MS]A:301 |
20 |
1 |
505 |
f |
A |
x,y,z |
1_555 |
37 |
15 |
8905 |
295.7 |
-1.2 |
0.570 |
12 |
0 |
0 |
0.132 |
Average: |
296.4 |
-1.0 |
0.573 |
12 |
0 |
0 |
0.132 |
7 |
8 |
|
B |
22 |
7 |
8820 |
◊ |
B |
-x,y,-z+3/2 |
3_556 |
22 |
6 |
8820 |
200.9 |
-4.1 |
0.154 |
0 |
0 |
0 |
0.000 |
8 |
9 |
|
A |
18 |
7 |
8905 |
◊ |
A |
-x+1,y,-z+3/2 |
3_656 |
18 |
7 |
8905 |
153.6 |
-3.6 |
0.145 |
0 |
0 |
0 |
0.000 |
9 |
10 |
|
[GOL]A:303 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
8905 |
111.5 |
1.0 |
0.699 |
2 |
0 |
0 |
0.000 |
10 |
11 |
|
[PEG]B:302 |
7 |
1 |
255 |
f |
A |
x,y,z |
1_555 |
20 |
6 |
8905 |
106.0 |
2.7 |
0.373 |
1 |
0 |
0 |
0.000 |
11 |
12 |
|
[PEG]A:302 |
7 |
1 |
252 |
◊ |
B |
x,y,z |
1_555 |
21 |
6 |
8820 |
104.9 |
3.3 |
0.476 |
0 |
0 |
0 |
0.000 |
12 |
13 |
|
[GOL]B:303 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
8820 |
103.5 |
-0.8 |
0.475 |
2 |
0 |
0 |
0.018 |
13 |
14 |
|
[GOL]A:304 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
8905 |
101.7 |
-0.8 |
0.485 |
1 |
0 |
0 |
0.013 |
14 |
15 |
|
[SO4]A:306 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
8905 |
95.9 |
-14.8 |
0.603 |
5 |
0 |
0 |
0.185 |
15 |
16 |
|
[SO4]B:305 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
8820 |
94.4 |
-14.9 |
0.561 |
5 |
0 |
0 |
0.186 |
16 |
17 |
|
[PEG]A:302 |
5 |
1 |
252 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
8905 |
86.4 |
2.6 |
0.408 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
[PEG]B:302 |
6 |
1 |
255 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
8820 |
85.2 |
3.5 |
0.476 |
1 |
0 |
0 |
0.000 |
18 |
19 |
|
[GOL]A:304 |
5 |
1 |
218 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
8820 |
77.3 |
-0.5 |
0.446 |
0 |
0 |
0 |
0.006 |
19 |
20 |
|
[GOL]B:303 |
5 |
1 |
218 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
8905 |
76.1 |
-0.5 |
0.452 |
0 |
0 |
0 |
0.006 |
20 |
21 |
|
[MG]A:305 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
8905 |
41.6 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.115 |
22 |
|
[MG]B:304 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
8820 |
40.9 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.115 |
Average: |
41.3 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.115 |
21 |
23 |
|
[PEG]B:302 |
3 |
1 |
255 |
f |
[PEG]A:302 |
x,y,z |
1_555 |
3 |
1 |
252 |
33.1 |
0.9 |
0.162 |
1 |
0 |
0 |
0.000 |
22 |
24 |
|
[SO4]B:305 |
3 |
1 |
186 |
f |
[MG]B:304 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.5 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.075 |
23 |
25 |
|
[SO4]A:306 |
3 |
1 |
186 |
f |
[MG]A:305 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.6 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.070 |
24 |
26 |
|
A |
2 |
2 |
8905 |
◊ |
A |
x,-y,-z+2 |
4_557 |
2 |
2 |
8905 |
28.1 |
-0.9 |
0.139 |
0 |
0 |
0 |
0.000 |
25 |
27 |
|
[SO4]A:306 |
1 |
1 |
186 |
f |
[6MS]A:301 |
x,y,z |
1_555 |
2 |
1 |
505 |
16.4 |
-2.4 |
0.579 |
0 |
0 |
0 |
0.026 |
26 |
28 |
|
[SO4]B:305 |
1 |
1 |
186 |
f |
[6MS]B:301 |
x,y,z |
1_555 |
2 |
1 |
511 |
13.2 |
-1.9 |
0.582 |
0 |
0 |
0 |
0.020 |
27 |
29 |
|
B |
2 |
1 |
8820 |
◊ |
A |
x,-y+1,-z+2 |
4_567 |
1 |
1 |
8905 |
5.1 |
0.0 |
0.630 |
0 |
0 |
0 |
0.000 |
28 |
30 |
|
B |
1 |
1 |
8820 |
◊ |
B |
x,-y+1,-z+2 |
4_567 |
1 |
1 |
8820 |
2.7 |
0.1 |
0.748 |
0 |
0 |
0 |
0.000 |
29 |
31 |
|
B |
1 |
1 |
8820 |
◊ |
A |
x,-y,-z+2 |
4_557 |
1 |
1 |
8905 |
2.1 |
0.1 |
0.779 |
0 |
0 |
0 |
0.000 |
|