| ## |
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 |
|
D |
78 |
18 |
12916 |
◊ |
D |
y+1/3,x-1/3,-z+2/3 |
16_545 |
79 |
18 |
12916 |
600.0 |
-15.5 |
0.011 |
2 |
0 |
0 |
0.281 |
2 |
|
B |
78 |
17 |
12903 |
◊ |
A |
x,y,z |
1_555 |
74 |
18 |
12918 |
588.8 |
-15.2 |
0.010 |
2 |
0 |
0 |
0.281 |
3 |
|
C |
74 |
18 |
12914 |
◊ |
C |
y,x,-z |
4_555 |
74 |
18 |
12914 |
582.5 |
-15.3 |
0.008 |
2 |
0 |
0 |
0.281 |
| Average: |
590.4 |
-15.3 |
0.010 |
2 |
0 |
0 |
0.281 |
| 2 |
4 |
|
D |
54 |
14 |
12916 |
◊ |
C |
-x+y+2/3,-x+4/3,z+1/3 |
9_565 |
41 |
14 |
12914 |
419.4 |
-4.5 |
0.260 |
0 |
0 |
0 |
0.000 |
5 |
|
D |
40 |
14 |
12916 |
◊ |
B |
-y+5/3,x-y+1/3,z+1/3 |
8_655 |
55 |
14 |
12903 |
412.2 |
-4.4 |
0.263 |
0 |
0 |
0 |
0.000 |
6 |
|
B |
41 |
13 |
12903 |
◊ |
A |
-y+2,x-y+1,z |
2_765 |
52 |
14 |
12918 |
396.4 |
-4.4 |
0.263 |
0 |
0 |
0 |
0.000 |
7 |
|
C |
49 |
14 |
12914 |
◊ |
A |
x,y,z |
1_555 |
36 |
11 |
12918 |
373.0 |
-3.6 |
0.314 |
0 |
0 |
0 |
0.000 |
| Average: |
400.3 |
-4.2 |
0.275 |
0 |
0 |
0 |
0.000 |
| 3 |
8 |
|
C |
44 |
14 |
12914 |
◊ |
C |
x-y+2/3,-y+4/3,-z+1/3 |
11_565 |
44 |
14 |
12914 |
376.3 |
-0.0 |
0.668 |
4 |
12 |
0 |
0.000 |
9 |
|
D |
38 |
11 |
12916 |
◊ |
B |
x,y,z |
1_555 |
38 |
11 |
12903 |
330.5 |
-0.5 |
0.619 |
2 |
6 |
0 |
0.000 |
10 |
|
A |
33 |
10 |
12918 |
◊ |
A |
y,x,-z+1 |
4_556 |
33 |
10 |
12918 |
290.5 |
-0.6 |
0.599 |
2 |
4 |
0 |
0.000 |
| Average: |
332.4 |
-0.4 |
0.629 |
3 |
7 |
0 |
0.000 |
| 4 |
11 |
|
A |
35 |
10 |
12918 |
x |
A |
-y+2,x-y+1,z |
2_765 |
39 |
12 |
12918 |
304.9 |
-2.2 |
0.440 |
0 |
1 |
0 |
0.000 |
12 |
|
D |
37 |
12 |
12916 |
x |
C |
x-y+2/3,-y+4/3,-z+1/3 |
11_565 |
35 |
11 |
12914 |
296.9 |
-2.1 |
0.441 |
0 |
0 |
0 |
0.000 |
13 |
|
D |
35 |
10 |
12916 |
x |
B |
x-y+2/3,-y+4/3,-z+1/3 |
11_565 |
35 |
11 |
12903 |
261.2 |
-2.2 |
0.433 |
0 |
0 |
0 |
0.000 |
14 |
|
C |
35 |
11 |
12914 |
x |
B |
x,y,z |
1_555 |
32 |
9 |
12903 |
256.0 |
-2.5 |
0.391 |
0 |
0 |
0 |
0.000 |
| Average: |
279.8 |
-2.3 |
0.426 |
0 |
0 |
0 |
0.000 |
| 5 |
15 |
|
[PO4]B:320 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
23 |
10 |
12903 |
107.3 |
-7.7 |
0.659 |
4 |
0 |
0 |
0.326 |
16 |
|
[PO4]D:320 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
21 |
10 |
12916 |
107.0 |
-7.6 |
0.656 |
4 |
0 |
0 |
0.326 |
17 |
|
[PO4]C:320 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
21 |
10 |
12914 |
106.7 |
-7.7 |
0.657 |
4 |
0 |
0 |
0.326 |
18 |
|
[PO4]A:320 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
21 |
10 |
12918 |
106.7 |
-7.6 |
0.661 |
4 |
0 |
0 |
0.326 |
| Average: |
106.9 |
-7.6 |
0.658 |
4 |
0 |
0 |
0.326 |
| 6 |
19 |
|
[MG]D:321 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
11 |
8 |
12916 |
45.9 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.257 |
20 |
|
[MG]B:321 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
8 |
12903 |
45.8 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.257 |
21 |
|
[MG]A:321 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
8 |
12918 |
45.5 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.257 |
22 |
|
[MG]C:321 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
11 |
8 |
12914 |
45.4 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.257 |
| Average: |
45.6 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.257 |
| 7 |
23 |
|
[MG]A:321 |
1 |
1 |
98 |
f |
[PO4]A:320 |
x,y,z |
1_555 |
1 |
1 |
186 |
27.0 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.140 |
24 |
|
[MG]B:321 |
1 |
1 |
98 |
f |
[PO4]B:320 |
x,y,z |
1_555 |
2 |
1 |
187 |
26.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.140 |
25 |
|
[MG]D:321 |
1 |
1 |
98 |
f |
[PO4]D:320 |
x,y,z |
1_555 |
1 |
1 |
185 |
26.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.140 |
26 |
|
[MG]C:321 |
1 |
1 |
98 |
f |
[PO4]C:320 |
x,y,z |
1_555 |
1 |
1 |
187 |
26.8 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.140 |
| Average: |
26.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.140 |
|