| ## |
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 |
|
C |
60 |
16 |
8206 |
◊ |
A |
x,y,z |
1_555 |
63 |
15 |
9126 |
591.3 |
-0.9 |
0.578 |
0 |
0 |
0 |
0.000 |
2 |
|
E |
58 |
14 |
8287 |
◊ |
B |
x,y,z |
1_555 |
59 |
14 |
8836 |
588.3 |
-2.5 |
0.431 |
0 |
0 |
0 |
0.000 |
3 |
|
F |
52 |
14 |
8288 |
◊ |
D |
x,y,z |
1_555 |
50 |
14 |
8375 |
532.5 |
-2.6 |
0.408 |
0 |
0 |
0 |
0.000 |
| Average: |
570.7 |
-2.0 |
0.472 |
0 |
0 |
0 |
0.000 |
| 2 |
4 |
|
B |
69 |
19 |
8836 |
◊ |
A |
x-1,y,z |
1_455 |
72 |
19 |
9126 |
580.4 |
-3.1 |
0.371 |
0 |
0 |
0 |
0.000 |
| 3 |
5 |
|
B |
39 |
14 |
8836 |
◊ |
C |
x-1,y,z |
1_455 |
34 |
14 |
8206 |
345.8 |
0.2 |
0.602 |
0 |
0 |
0 |
0.000 |
| 4 |
6 |
|
B |
35 |
8 |
8836 |
◊ |
A |
x,y,z |
1_555 |
39 |
12 |
9126 |
323.1 |
2.2 |
0.819 |
0 |
0 |
0 |
0.000 |
7 |
|
D |
39 |
12 |
8375 |
◊ |
A |
x,y,z |
1_555 |
35 |
8 |
9126 |
317.3 |
1.4 |
0.758 |
0 |
0 |
0 |
0.000 |
8 |
|
F |
41 |
13 |
8288 |
◊ |
E |
x,y,z |
1_555 |
33 |
8 |
8287 |
312.7 |
1.3 |
0.748 |
0 |
0 |
0 |
0.000 |
9 |
|
F |
35 |
8 |
8288 |
◊ |
C |
x,y,z |
1_555 |
37 |
13 |
8206 |
311.9 |
1.4 |
0.740 |
0 |
0 |
0 |
0.000 |
10 |
|
D |
36 |
8 |
8375 |
◊ |
B |
x,y,z |
1_555 |
39 |
13 |
8836 |
307.1 |
1.3 |
0.738 |
0 |
0 |
0 |
0.000 |
11 |
|
E |
36 |
12 |
8287 |
◊ |
C |
x,y,z |
1_555 |
31 |
8 |
8206 |
298.4 |
0.8 |
0.676 |
0 |
0 |
0 |
0.000 |
| Average: |
311.7 |
1.4 |
0.746 |
0 |
0 |
0 |
0.000 |
| 5 |
12 |
|
F |
31 |
7 |
8288 |
◊ |
B |
x,y,z |
1_555 |
31 |
7 |
8836 |
280.6 |
-2.7 |
0.294 |
0 |
0 |
0 |
0.000 |
13 |
|
D |
31 |
7 |
8375 |
◊ |
C |
x,y,z |
1_555 |
31 |
7 |
8206 |
272.4 |
-2.8 |
0.279 |
0 |
0 |
0 |
0.000 |
14 |
|
E |
30 |
7 |
8287 |
◊ |
A |
x,y,z |
1_555 |
31 |
7 |
9126 |
267.4 |
-2.8 |
0.286 |
0 |
0 |
0 |
0.000 |
| Average: |
273.4 |
-2.8 |
0.286 |
0 |
0 |
0 |
0.000 |
| 6 |
15 |
|
A |
31 |
7 |
9126 |
◊ |
F |
-x+3/2,-y+2,z-1/2 |
2_674 |
39 |
12 |
8288 |
278.2 |
-4.2 |
0.190 |
0 |
0 |
0 |
0.000 |
| 7 |
16 |
|
E |
30 |
8 |
8287 |
◊ |
D |
-x+2,y-1/2,-z+1/2 |
3_745 |
33 |
8 |
8375 |
255.8 |
-1.4 |
0.423 |
0 |
0 |
0 |
0.000 |
| 8 |
17 |
|
A |
24 |
5 |
9126 |
x |
A |
x-1/2,-y+3/2,-z |
4_465 |
26 |
7 |
9126 |
210.6 |
0.2 |
0.602 |
0 |
0 |
0 |
0.000 |
| 9 |
18 |
|
D |
22 |
6 |
8375 |
◊ |
F |
-x+3/2,-y+2,z-1/2 |
2_674 |
18 |
4 |
8288 |
194.6 |
-1.4 |
0.383 |
0 |
0 |
0 |
0.000 |
| 10 |
19 |
|
B |
13 |
3 |
8836 |
◊ |
A |
x-1/2,-y+3/2,-z |
4_465 |
14 |
4 |
9126 |
114.0 |
-2.0 |
0.222 |
0 |
0 |
0 |
0.000 |
| 11 |
20 |
|
B |
9 |
3 |
8836 |
◊ |
F |
-x+3/2,-y+2,z-1/2 |
2_674 |
12 |
3 |
8288 |
94.6 |
-1.5 |
0.247 |
0 |
0 |
0 |
0.000 |
| 12 |
21 |
|
C |
14 |
4 |
8206 |
◊ |
D |
-x+2,y-1/2,-z+1/2 |
3_745 |
14 |
4 |
8375 |
89.6 |
-0.6 |
0.473 |
0 |
0 |
0 |
0.000 |
| 13 |
22 |
|
[MG]F:202 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
15 |
6 |
8288 |
65.4 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.100 |
23 |
|
[MG]C:202 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
15 |
6 |
8206 |
65.1 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.100 |
24 |
|
[MG]D:202 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
15 |
5 |
8375 |
61.5 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.100 |
25 |
|
[MG]A:202 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
9126 |
59.8 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.100 |
26 |
|
[MG]B:202 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
8836 |
59.6 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.100 |
27 |
|
[MG]E:202 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
17 |
8 |
8287 |
59.1 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.100 |
| Average: |
61.8 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.100 |
| 14 |
28 |
|
[PO4]B:203 |
4 |
1 |
190 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
8836 |
56.4 |
-3.3 |
0.664 |
0 |
0 |
0 |
0.027 |
| 15 |
29 |
|
[PO4]B:203 |
4 |
1 |
190 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
8375 |
55.6 |
-3.3 |
0.676 |
0 |
0 |
0 |
0.000 |
| 16 |
30 |
|
[PO4]B:203 |
4 |
1 |
190 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
9126 |
52.6 |
-3.2 |
0.685 |
0 |
0 |
0 |
0.000 |
| 17 |
31 |
|
E |
3 |
2 |
8287 |
◊ |
C |
x-1,y,z |
1_455 |
6 |
4 |
8206 |
34.8 |
-0.2 |
0.420 |
0 |
0 |
0 |
0.000 |
| 18 |
32 |
|
B |
2 |
2 |
8836 |
◊ |
F |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
2 |
8288 |
13.8 |
-0.1 |
0.461 |
0 |
0 |
0 |
0.000 |
| 19 |
33 |
|
D |
2 |
2 |
8375 |
◊ |
E |
-x+3/2,-y+2,z-1/2 |
2_674 |
2 |
2 |
8287 |
9.8 |
-0.3 |
0.340 |
0 |
0 |
0 |
0.000 |
| 20 |
34 |
|
A |
1 |
1 |
9126 |
◊ |
F |
-x+2,y-1/2,-z+1/2 |
3_745 |
2 |
1 |
8288 |
3.8 |
0.1 |
0.683 |
0 |
0 |
0 |
0.000 |
|