| ## |
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 |
173 |
41 |
11251 |
◊ |
A |
x,x-y,-z+1/6 |
12_555 |
167 |
41 |
10952 |
1686.3 |
-23.3 |
0.069 |
15 |
10 |
0 |
0.530 |
2 |
|
C |
167 |
40 |
10743 |
◊ |
C |
x,x-y,-z+1/6 |
12_555 |
163 |
40 |
10743 |
1659.9 |
-23.6 |
0.077 |
12 |
8 |
0 |
0.530 |
| Average: |
1673.1 |
-23.4 |
0.073 |
14 |
9 |
0 |
0.530 |
| 2 |
3 |
|
C |
159 |
45 |
10743 |
◊ |
B |
x,x-y,-z+1/6 |
12_555 |
159 |
42 |
11251 |
1561.8 |
-22.0 |
0.069 |
3 |
0 |
0 |
0.425 |
4 |
|
A |
151 |
41 |
10952 |
◊ |
A |
x,x-y,-z+1/6 |
12_555 |
151 |
41 |
10952 |
1495.9 |
-22.7 |
0.048 |
2 |
0 |
0 |
0.425 |
| Average: |
1528.9 |
-22.4 |
0.058 |
3 |
0 |
0 |
0.425 |
| 3 |
5 |
|
B |
79 |
24 |
11251 |
◊ |
B |
-y+1,-x+1,-z-1/6 |
10_664 |
79 |
24 |
11251 |
740.9 |
-0.4 |
0.752 |
7 |
0 |
0 |
0.000 |
| 4 |
6 |
|
C |
30 |
9 |
10743 |
◊ |
A |
y,x-1,-z+1/3 |
7_545 |
32 |
9 |
10952 |
310.0 |
-0.3 |
0.701 |
2 |
2 |
0 |
0.000 |
| 5 |
7 |
|
A |
40 |
11 |
10952 |
◊ |
C |
x-y+1,x,z+1/6 |
6_655 |
38 |
8 |
10743 |
291.8 |
-2.0 |
0.581 |
1 |
1 |
0 |
0.000 |
| 6 |
8 |
|
[MTP]B:1246 |
20 |
1 |
449 |
f |
B |
x,y,z |
1_555 |
41 |
16 |
11251 |
282.9 |
-2.5 |
0.409 |
2 |
0 |
0 |
0.136 |
9 |
|
[MTP]A:1245 |
20 |
1 |
446 |
f |
A |
x,y,z |
1_555 |
42 |
16 |
10952 |
281.6 |
-2.7 |
0.418 |
2 |
0 |
0 |
0.136 |
10 |
|
[MTP]C:1247 |
20 |
1 |
444 |
f |
C |
x,y,z |
1_555 |
42 |
17 |
10743 |
279.8 |
-3.2 |
0.374 |
2 |
0 |
0 |
0.136 |
| Average: |
281.4 |
-2.8 |
0.400 |
2 |
0 |
0 |
0.136 |
| 7 |
11 |
|
B |
10 |
5 |
11251 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
10952 |
106.8 |
1.1 |
0.811 |
1 |
0 |
0 |
0.000 |
12 |
|
C |
11 |
4 |
10743 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
10952 |
93.8 |
0.6 |
0.717 |
1 |
0 |
0 |
0.000 |
13 |
|
C |
10 |
4 |
10743 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
11251 |
83.4 |
1.0 |
0.792 |
1 |
0 |
0 |
0.000 |
| Average: |
94.7 |
0.9 |
0.773 |
1 |
0 |
0 |
0.000 |
| 8 |
14 |
|
[PO4]A:1248 |
5 |
1 |
190 |
f |
A |
x,y,z |
1_555 |
22 |
10 |
10952 |
95.7 |
-5.5 |
0.735 |
7 |
0 |
0 |
0.310 |
| 9 |
15 |
|
[PO4]B:1249 |
5 |
1 |
190 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
11251 |
87.0 |
-5.3 |
0.716 |
5 |
0 |
0 |
0.137 |
| 10 |
16 |
|
[PO4]C:1250 |
5 |
1 |
190 |
f |
C |
x,y,z |
1_555 |
19 |
10 |
10743 |
79.5 |
-4.8 |
0.832 |
8 |
0 |
0 |
0.279 |
| 11 |
17 |
|
C |
9 |
4 |
10743 |
◊ |
B |
-y+1,x-y,z+1/3 |
2_655 |
12 |
3 |
11251 |
66.5 |
0.5 |
0.741 |
1 |
0 |
0 |
0.000 |
| 12 |
18 |
|
[MTP]B:1246 |
7 |
1 |
449 |
◊ |
C |
x,x-y,-z+1/6 |
12_555 |
7 |
3 |
10743 |
63.9 |
1.0 |
0.721 |
2 |
0 |
0 |
0.001 |
19 |
|
[MTP]C:1247 |
7 |
1 |
444 |
◊ |
B |
x,x-y,-z+1/6 |
12_555 |
7 |
3 |
11251 |
62.2 |
0.9 |
0.720 |
2 |
0 |
0 |
0.001 |
20 |
|
[MTP]A:1245 |
7 |
1 |
446 |
◊ |
A |
x,x-y,-z+1/6 |
12_555 |
7 |
3 |
10952 |
60.6 |
0.9 |
0.712 |
2 |
0 |
0 |
0.001 |
| Average: |
62.2 |
0.9 |
0.718 |
2 |
0 |
0 |
0.001 |
| 13 |
21 |
|
[MTP]B:1246 |
6 |
1 |
449 |
f |
[PO4]B:1249 |
x,y,z |
1_555 |
4 |
1 |
190 |
43.5 |
-2.5 |
0.686 |
0 |
0 |
0 |
0.045 |
| 14 |
22 |
|
[MTP]A:1245 |
6 |
1 |
446 |
f |
[PO4]A:1248 |
x,y,z |
1_555 |
4 |
1 |
190 |
42.2 |
-2.3 |
0.681 |
0 |
0 |
0 |
0.082 |
| 15 |
23 |
|
[MTP]C:1247 |
6 |
1 |
444 |
f |
[PO4]C:1250 |
x,y,z |
1_555 |
4 |
1 |
190 |
41.6 |
-2.5 |
0.658 |
0 |
0 |
0 |
0.082 |
| 16 |
24 |
|
[PO4]A:1248 |
4 |
1 |
190 |
◊ |
A |
x,x-y,-z+1/6 |
12_555 |
3 |
1 |
10952 |
36.8 |
-0.5 |
0.965 |
2 |
0 |
0 |
0.051 |
| 17 |
25 |
|
[PO4]B:1249 |
3 |
1 |
190 |
◊ |
C |
x,x-y,-z+1/6 |
12_555 |
3 |
1 |
10743 |
36.0 |
-0.7 |
0.924 |
3 |
0 |
0 |
0.036 |
| 18 |
26 |
|
[PO4]C:1250 |
3 |
1 |
190 |
◊ |
B |
x,x-y,-z+1/6 |
12_555 |
2 |
1 |
11251 |
31.0 |
-0.6 |
0.925 |
2 |
0 |
0 |
0.027 |
| 19 |
27 |
|
A |
5 |
2 |
10952 |
◊ |
B |
x-y+1,x,z+1/6 |
6_655 |
3 |
1 |
11251 |
21.9 |
0.2 |
0.715 |
0 |
0 |
0 |
0.000 |
|