## |
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 |
101 |
34 |
15294 |
◊ |
A |
x,y,z |
1_555 |
89 |
31 |
15505 |
948.1 |
-6.7 |
0.420 |
10 |
6 |
0 |
0.209 |
2 |
2 |
|
B |
52 |
15 |
15294 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
44 |
12 |
15505 |
441.2 |
-3.3 |
0.464 |
9 |
2 |
0 |
0.000 |
3 |
|
B |
46 |
13 |
15294 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
42 |
12 |
15505 |
441.1 |
-1.4 |
0.593 |
7 |
2 |
0 |
0.000 |
Average: |
441.2 |
-2.4 |
0.529 |
8 |
2 |
0 |
0.000 |
3 |
4 |
|
B |
36 |
12 |
15294 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
41 |
11 |
15505 |
324.2 |
-4.3 |
0.306 |
3 |
0 |
0 |
0.000 |
4 |
5 |
|
[ADP]A:2601 |
26 |
1 |
549 |
f |
A |
x,y,z |
1_555 |
45 |
17 |
15505 |
308.3 |
-6.6 |
0.508 |
12 |
0 |
0 |
0.396 |
6 |
|
[ADP]B:2600 |
26 |
1 |
547 |
f |
B |
x,y,z |
1_555 |
46 |
17 |
15294 |
308.2 |
-5.5 |
0.585 |
12 |
0 |
0 |
0.396 |
Average: |
308.2 |
-6.0 |
0.546 |
12 |
0 |
0 |
0.396 |
5 |
7 |
|
A |
11 |
6 |
15505 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
21 |
6 |
15505 |
173.9 |
-0.4 |
0.233 |
0 |
1 |
0 |
0.000 |
6 |
8 |
|
B |
17 |
6 |
15294 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
15 |
5 |
15294 |
165.0 |
-0.9 |
0.354 |
1 |
0 |
0 |
0.000 |
7 |
9 |
|
B |
18 |
5 |
15294 |
x |
B |
-x,y-1/2,-z |
2_545 |
22 |
7 |
15294 |
164.5 |
-0.6 |
0.567 |
2 |
0 |
0 |
0.000 |
8 |
10 |
|
A |
16 |
5 |
15505 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
11 |
4 |
15505 |
114.8 |
1.2 |
0.833 |
4 |
3 |
0 |
0.000 |
9 |
11 |
|
[NO3]A:2001 |
4 |
1 |
168 |
f |
A |
x,y,z |
1_555 |
26 |
11 |
15505 |
106.4 |
1.6 |
0.811 |
2 |
0 |
0 |
0.000 |
10 |
12 |
|
A |
11 |
3 |
15505 |
x |
A |
x-1,y,z |
1_455 |
6 |
3 |
15505 |
73.0 |
-1.4 |
0.248 |
0 |
0 |
0 |
0.000 |
11 |
13 |
|
[ADP]B:2600 |
8 |
1 |
547 |
◊ |
A |
x,y,z |
1_555 |
9 |
2 |
15505 |
72.0 |
-0.8 |
0.642 |
0 |
0 |
0 |
0.035 |
14 |
|
[ADP]A:2601 |
5 |
1 |
549 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
15294 |
46.8 |
-0.8 |
0.617 |
1 |
0 |
0 |
0.035 |
Average: |
59.4 |
-0.8 |
0.629 |
1 |
0 |
0 |
0.035 |
12 |
15 |
|
[NO3]A:2000 |
4 |
1 |
169 |
◊ |
B |
x,y,z |
1_555 |
13 |
3 |
15294 |
69.3 |
1.2 |
0.516 |
2 |
0 |
0 |
0.000 |
13 |
16 |
|
B |
6 |
2 |
15294 |
◊ |
[ADP]A:2601 |
-x+1,y-1/2,-z |
2_645 |
12 |
1 |
549 |
67.3 |
-0.4 |
0.300 |
0 |
0 |
0 |
0.000 |
17 |
|
[ADP]B:2600 |
13 |
1 |
547 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
3 |
15505 |
66.1 |
-0.5 |
0.298 |
0 |
0 |
0 |
0.000 |
Average: |
66.7 |
-0.5 |
0.299 |
0 |
0 |
0 |
0.000 |
14 |
18 |
|
[NO3]A:2000 |
4 |
1 |
169 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
15505 |
65.5 |
0.6 |
0.448 |
2 |
0 |
0 |
0.006 |
15 |
19 |
|
B |
8 |
2 |
15294 |
x |
B |
x-1,y,z |
1_455 |
11 |
2 |
15294 |
58.9 |
-1.1 |
0.405 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
[MG]A:1365 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
15505 |
55.3 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.174 |
21 |
|
[MG]B:1365 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
15294 |
32.5 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.174 |
Average: |
43.9 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.174 |
17 |
22 |
|
[ADP]B:2600 |
6 |
1 |
547 |
f |
[MG]B:1365 |
x,y,z |
1_555 |
1 |
1 |
98 |
36.7 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.180 |
23 |
|
[ADP]A:2601 |
3 |
1 |
549 |
f |
[MG]A:1365 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.180 |
Average: |
33.3 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.180 |
18 |
24 |
|
[MG]B:1365 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
15505 |
9.7 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.017 |
|