| ## |
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 |
|
A |
72 |
27 |
16808 |
x |
A |
x,y-1,z |
1_545 |
83 |
23 |
16808 |
635.9 |
-6.6 |
0.248 |
4 |
1 |
0 |
0.000 |
2 |
|
B |
68 |
23 |
15681 |
x |
B |
x-1,y,z |
1_455 |
73 |
19 |
15681 |
598.5 |
-4.3 |
0.325 |
7 |
4 |
0 |
0.000 |
| Average: |
617.2 |
-5.4 |
0.286 |
6 |
3 |
0 |
0.000 |
| 2 |
3 |
|
B |
58 |
15 |
15681 |
◊ |
A |
x,y,z |
1_555 |
57 |
14 |
16808 |
560.7 |
3.4 |
0.858 |
10 |
17 |
0 |
0.000 |
| 3 |
4 |
|
B |
53 |
13 |
15681 |
◊ |
A |
x,y,z-1 |
1_554 |
58 |
17 |
16808 |
485.1 |
-0.9 |
0.564 |
3 |
3 |
0 |
0.000 |
| 4 |
5 |
|
A |
49 |
16 |
16808 |
◊ |
B |
x-1,y,z |
1_455 |
47 |
17 |
15681 |
424.0 |
-1.0 |
0.564 |
5 |
2 |
0 |
0.000 |
6 |
|
B |
34 |
14 |
15681 |
◊ |
A |
x,y-1,z |
1_545 |
38 |
13 |
16808 |
378.8 |
-1.0 |
0.537 |
4 |
4 |
0 |
0.000 |
| Average: |
401.4 |
-1.0 |
0.550 |
5 |
3 |
0 |
0.000 |
| 5 |
7 |
|
[ADP]B:402 |
27 |
1 |
553 |
f |
B |
x,y,z |
1_555 |
43 |
16 |
15681 |
313.2 |
-6.1 |
0.421 |
12 |
0 |
0 |
0.050 |
8 |
|
[ADP]A:402 |
27 |
1 |
548 |
f |
A |
x,y,z |
1_555 |
45 |
16 |
16808 |
310.5 |
-6.8 |
0.417 |
10 |
0 |
0 |
0.050 |
| Average: |
311.8 |
-6.5 |
0.419 |
11 |
0 |
0 |
0.050 |
| 6 |
9 |
|
A |
23 |
8 |
16808 |
x |
A |
x-1,y-1,z |
1_445 |
19 |
6 |
16808 |
179.3 |
-0.3 |
0.588 |
5 |
4 |
0 |
0.000 |
10 |
|
B |
20 |
7 |
15681 |
x |
B |
x-1,y-1,z |
1_445 |
15 |
4 |
15681 |
160.0 |
0.4 |
0.664 |
5 |
4 |
0 |
0.000 |
| Average: |
169.6 |
0.1 |
0.626 |
5 |
4 |
0 |
0.000 |
| 7 |
11 |
|
[NO3]B:403 |
4 |
1 |
161 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
15681 |
84.1 |
1.1 |
0.560 |
3 |
0 |
0 |
0.000 |
| 8 |
12 |
|
A |
8 |
4 |
16808 |
x |
A |
x-1,y,z |
1_455 |
9 |
4 |
16808 |
68.1 |
-0.4 |
0.518 |
0 |
0 |
0 |
0.000 |
13 |
|
B |
3 |
2 |
15681 |
x |
B |
x,y-1,z |
1_545 |
2 |
1 |
15681 |
40.3 |
-1.3 |
0.077 |
0 |
0 |
0 |
0.000 |
| Average: |
54.2 |
-0.8 |
0.297 |
0 |
0 |
0 |
0.000 |
| 9 |
14 |
|
[MG]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
16808 |
52.4 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.027 |
15 |
|
[MG]B:401 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
15681 |
51.5 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.027 |
| Average: |
52.0 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.027 |
| 10 |
16 |
|
[ADP]A:402 |
5 |
1 |
548 |
◊ |
A |
x-1,y-1,z |
1_445 |
3 |
1 |
16808 |
46.5 |
-1.2 |
0.178 |
0 |
0 |
0 |
0.000 |
| 11 |
17 |
|
[NO3]B:403 |
3 |
1 |
161 |
◊ |
A |
x,y,z-1 |
1_554 |
6 |
2 |
16808 |
42.5 |
1.4 |
0.948 |
1 |
0 |
0 |
0.000 |
| 12 |
18 |
|
[ADP]B:402 |
5 |
1 |
553 |
f |
[MG]B:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
33.3 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.023 |
19 |
|
[ADP]A:402 |
4 |
1 |
548 |
f |
[MG]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
33.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.023 |
| Average: |
33.2 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.023 |
| 13 |
20 |
|
[ADP]B:402 |
3 |
1 |
553 |
◊ |
B |
x-1,y-1,z |
1_445 |
3 |
1 |
15681 |
12.9 |
-0.6 |
0.433 |
0 |
0 |
0 |
0.000 |
|