| ## |
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 |
73 |
19 |
15798 |
◊ |
A |
x,y,z |
1_555 |
58 |
18 |
15565 |
661.9 |
-4.9 |
0.198 |
12 |
4 |
0 |
0.225 |
2 |
|
C |
55 |
19 |
16454 |
◊ |
A |
x,y,z |
1_555 |
72 |
20 |
15565 |
648.9 |
-4.6 |
0.175 |
13 |
3 |
0 |
0.225 |
3 |
|
C |
72 |
20 |
16454 |
◊ |
B |
x,y,z |
1_555 |
53 |
16 |
15798 |
630.4 |
-5.7 |
0.084 |
13 |
3 |
0 |
0.225 |
| Average: |
647.1 |
-5.0 |
0.152 |
13 |
3 |
0 |
0.225 |
| 2 |
4 |
|
A |
52 |
18 |
15565 |
◊ |
C |
-y,x-y,z+2/3 |
2_555 |
47 |
11 |
16454 |
462.9 |
-6.1 |
0.231 |
1 |
0 |
0 |
0.000 |
| 3 |
5 |
|
B |
48 |
14 |
15798 |
◊ |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
51 |
15 |
15565 |
369.3 |
3.4 |
0.891 |
10 |
4 |
0 |
0.000 |
| 4 |
6 |
|
[ADP]A:1367 |
26 |
1 |
554 |
f |
A |
x,y,z |
1_555 |
45 |
17 |
15565 |
323.7 |
-4.8 |
0.601 |
10 |
0 |
0 |
0.201 |
7 |
|
[ADP]B:1367 |
26 |
1 |
551 |
f |
B |
x,y,z |
1_555 |
45 |
17 |
15798 |
321.6 |
-5.8 |
0.453 |
11 |
0 |
0 |
0.201 |
8 |
|
[ADP]C:1366 |
27 |
1 |
548 |
f |
C |
x,y,z |
1_555 |
43 |
17 |
16454 |
313.9 |
-5.6 |
0.529 |
10 |
0 |
0 |
0.201 |
| Average: |
319.7 |
-5.4 |
0.528 |
10 |
0 |
0 |
0.201 |
| 5 |
9 |
|
A |
27 |
7 |
15565 |
◊ |
B |
-y,x-y,z-1/3 |
2_554 |
31 |
10 |
15798 |
275.1 |
-1.4 |
0.495 |
2 |
4 |
0 |
0.000 |
| 6 |
10 |
|
[SO4]B:1369 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
15798 |
99.1 |
-14.7 |
0.712 |
3 |
0 |
0 |
0.108 |
| 7 |
11 |
|
C |
9 |
5 |
16454 |
◊ |
A |
-y,x-y,z-1/3 |
2_554 |
12 |
3 |
15565 |
90.7 |
-0.7 |
0.366 |
0 |
0 |
0 |
0.000 |
| 8 |
12 |
|
[SO4]C:1367 |
5 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
13 |
5 |
16454 |
88.7 |
-13.2 |
0.836 |
6 |
0 |
0 |
0.106 |
| 9 |
13 |
|
B |
13 |
6 |
15798 |
◊ |
C |
-y+1,x-y+1,z+2/3 |
2_665 |
7 |
2 |
16454 |
87.9 |
-1.3 |
0.298 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
[SO4]B:1368 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
15798 |
85.7 |
-12.0 |
0.865 |
3 |
0 |
0 |
0.090 |
| 11 |
15 |
|
[MG]C:1365 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
14 |
7 |
16454 |
57.7 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.115 |
16 |
|
[MG]A:1366 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
15565 |
54.3 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.115 |
17 |
|
[MG]B:1366 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
15798 |
53.9 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.115 |
| Average: |
55.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.115 |
| 12 |
18 |
|
[CL]A:1368 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
15565 |
47.2 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.042 |
| 13 |
19 |
|
[ADP]B:1367 |
4 |
1 |
551 |
f |
[MG]B:1366 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.6 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.100 |
20 |
|
[ADP]C:1366 |
4 |
1 |
548 |
f |
[MG]C:1365 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.3 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.100 |
21 |
|
[ADP]A:1367 |
4 |
1 |
554 |
f |
[MG]A:1366 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.5 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.100 |
| Average: |
31.8 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.100 |
| 14 |
22 |
|
C |
1 |
1 |
16454 |
◊ |
B |
-y+1,x-y,z-1/3 |
2_654 |
2 |
1 |
15798 |
26.8 |
-0.9 |
0.101 |
0 |
0 |
0 |
0.000 |
| 15 |
23 |
|
[CL]A:1368 |
1 |
1 |
125 |
f |
[ADP]A:1367 |
x,y,z |
1_555 |
4 |
1 |
554 |
19.9 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.014 |
| 16 |
24 |
|
[ADP]C:1366 |
1 |
1 |
548 |
◊ |
A |
-y,x-y,z-1/3 |
2_554 |
1 |
1 |
15565 |
1.3 |
0.0 |
0.504 |
0 |
0 |
0 |
0.000 |
|