| ## |
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 |
93 |
28 |
33517 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
97 |
26 |
33517 |
879.9 |
-4.3 |
0.515 |
8 |
5 |
0 |
0.000 |
| 2 |
2 |
|
B |
66 |
18 |
32549 |
◊ |
A |
x,y,z |
1_555 |
76 |
25 |
33517 |
625.7 |
-2.8 |
0.572 |
5 |
3 |
0 |
0.000 |
| 3 |
3 |
|
A |
67 |
25 |
33517 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
80 |
26 |
32549 |
605.6 |
3.6 |
0.894 |
8 |
7 |
0 |
0.000 |
| 4 |
4 |
|
A |
47 |
12 |
33517 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
50 |
16 |
32549 |
480.0 |
-4.7 |
0.305 |
6 |
6 |
0 |
0.000 |
| 5 |
5 |
|
[ADP]A:801 |
27 |
1 |
553 |
f |
A |
x,y,z |
1_555 |
67 |
26 |
33517 |
381.5 |
-6.6 |
0.506 |
14 |
0 |
0 |
0.038 |
6 |
|
[ADP]B:801 |
27 |
1 |
546 |
f |
B |
x,y,z |
1_555 |
73 |
28 |
32549 |
375.5 |
-6.8 |
0.538 |
14 |
0 |
0 |
0.038 |
| Average: |
378.5 |
-6.7 |
0.522 |
14 |
0 |
0 |
0.038 |
| 6 |
7 |
|
B |
32 |
9 |
32549 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
36 |
9 |
33517 |
302.5 |
0.1 |
0.693 |
1 |
0 |
0 |
0.000 |
| 7 |
8 |
|
B |
35 |
11 |
32549 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
23 |
12 |
33517 |
228.9 |
2.3 |
0.832 |
2 |
2 |
0 |
0.000 |
| 8 |
9 |
|
[GOL]B:805 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
31 |
14 |
32549 |
167.4 |
-1.5 |
0.425 |
0 |
0 |
0 |
0.004 |
| 9 |
10 |
|
[GOL]A:807 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
31 |
14 |
33517 |
160.7 |
-1.8 |
0.389 |
1 |
0 |
0 |
0.007 |
| 10 |
11 |
|
[GOL]A:806 |
6 |
1 |
217 |
◊ |
A |
x,y,z |
1_555 |
14 |
7 |
33517 |
125.5 |
-0.1 |
0.616 |
1 |
0 |
0 |
0.000 |
| 11 |
12 |
|
[GOL]B:806 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
21 |
10 |
32549 |
121.5 |
-0.1 |
0.590 |
3 |
0 |
0 |
0.003 |
| 12 |
13 |
|
[GOL]A:804 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
21 |
8 |
33517 |
119.8 |
-0.3 |
0.564 |
4 |
0 |
0 |
0.006 |
| 13 |
14 |
|
[PO4]B:804 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
21 |
10 |
32549 |
117.8 |
-8.3 |
0.646 |
3 |
0 |
0 |
0.023 |
| 14 |
15 |
|
[GOL]A:805 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
33517 |
106.6 |
0.5 |
0.691 |
1 |
0 |
0 |
0.000 |
| 15 |
16 |
|
[VO4]B:802 |
5 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
28 |
14 |
32549 |
103.3 |
-1.7 |
0.542 |
0 |
0 |
0 |
0.005 |
17 |
|
[VO4]A:802 |
5 |
1 |
215 |
f |
A |
x,y,z |
1_555 |
27 |
14 |
33517 |
103.2 |
-1.8 |
0.529 |
0 |
0 |
0 |
0.005 |
| Average: |
103.3 |
-1.7 |
0.536 |
0 |
0 |
0 |
0.005 |
| 16 |
18 |
|
[GOL]A:806 |
5 |
1 |
217 |
f |
B |
-x-1/2,-y,z-1/2 |
2_454 |
12 |
5 |
32549 |
58.5 |
-0.8 |
0.451 |
0 |
0 |
0 |
0.002 |
| 17 |
19 |
|
[VO4]A:802 |
4 |
1 |
215 |
f |
[ADP]A:801 |
x,y,z |
1_555 |
5 |
1 |
553 |
45.7 |
-3.7 |
0.362 |
0 |
0 |
0 |
0.011 |
20 |
|
[VO4]B:802 |
4 |
1 |
215 |
f |
[ADP]B:801 |
x,y,z |
1_555 |
5 |
1 |
546 |
45.1 |
-3.6 |
0.375 |
0 |
0 |
0 |
0.011 |
| Average: |
45.4 |
-3.6 |
0.369 |
0 |
0 |
0 |
0.011 |
| 18 |
21 |
|
[GOL]A:805 |
4 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
32549 |
45.4 |
0.4 |
0.753 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
[MG]A:803 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
33517 |
36.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.016 |
23 |
|
[MG]B:803 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
32549 |
36.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.016 |
| Average: |
36.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.016 |
| 20 |
24 |
|
[MG]A:803 |
1 |
1 |
98 |
f |
[ADP]A:801 |
x,y,z |
1_555 |
4 |
1 |
553 |
24.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.011 |
25 |
|
[MG]B:803 |
1 |
1 |
98 |
f |
[ADP]B:801 |
x,y,z |
1_555 |
4 |
1 |
546 |
24.6 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.011 |
| Average: |
24.7 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.011 |
| 21 |
26 |
|
[MG]A:803 |
1 |
1 |
98 |
f |
[VO4]A:802 |
x,y,z |
1_555 |
2 |
1 |
215 |
22.1 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.006 |
27 |
|
[MG]B:803 |
1 |
1 |
98 |
f |
[VO4]B:802 |
x,y,z |
1_555 |
2 |
1 |
215 |
21.8 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.006 |
| Average: |
21.9 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.006 |
| 22 |
28 |
|
B |
3 |
2 |
32549 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
3 |
3 |
32549 |
7.2 |
-0.0 |
0.581 |
0 |
0 |
0 |
0.000 |
|