## |
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 |
52 |
7 |
8673 |
◊ |
A |
x,y,z |
1_555 |
55 |
7 |
8504 |
441.9 |
-8.9 |
0.875 |
14 |
0 |
0 |
0.294 |
2 |
|
C |
55 |
8 |
8673 |
◊ |
C |
-x+1,y,-z+2 |
2_657 |
55 |
8 |
8673 |
419.6 |
-5.3 |
0.937 |
6 |
0 |
0 |
0.294 |
Average: |
430.7 |
-7.1 |
0.906 |
10 |
0 |
0 |
0.294 |
2 |
3 |
|
B |
34 |
3 |
8673 |
◊ |
A |
x,y,z-1 |
1_554 |
32 |
3 |
8504 |
291.2 |
7.2 |
0.997 |
3 |
0 |
0 |
0.000 |
3 |
4 |
|
C |
36 |
3 |
8673 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
36 |
3 |
8673 |
277.7 |
6.9 |
0.996 |
4 |
0 |
0 |
0.000 |
4 |
5 |
|
B |
23 |
3 |
8673 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
27 |
9 |
8504 |
229.4 |
-9.0 |
0.519 |
2 |
0 |
0 |
0.022 |
5 |
6 |
|
B |
23 |
2 |
8673 |
◊ |
C |
x-1/2,y+1/2,z-1 |
3_454 |
37 |
9 |
8673 |
228.1 |
-1.0 |
0.916 |
3 |
0 |
0 |
0.030 |
7 |
|
C |
21 |
2 |
8673 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
30 |
7 |
8504 |
205.5 |
1.0 |
0.935 |
4 |
0 |
0 |
0.030 |
Average: |
216.8 |
-0.0 |
0.925 |
4 |
0 |
0 |
0.030 |
6 |
8 |
|
B |
30 |
7 |
8673 |
◊ |
C |
x-1/2,y-1/2,z-1 |
3_444 |
25 |
3 |
8673 |
224.8 |
-4.2 |
0.780 |
2 |
0 |
0 |
0.048 |
7 |
9 |
|
A |
26 |
5 |
8504 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
22 |
5 |
8504 |
155.1 |
-4.5 |
0.741 |
0 |
0 |
0 |
0.000 |
8 |
10 |
|
[CS]C:501 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
16 |
8 |
8673 |
108.4 |
-30.8 |
0.000 |
0 |
0 |
0 |
0.574 |
11 |
|
[CS]A:101 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
8504 |
103.1 |
-29.5 |
0.000 |
0 |
0 |
0 |
0.574 |
Average: |
105.7 |
-30.1 |
0.000 |
0 |
0 |
0 |
0.574 |
9 |
12 |
|
[PO4]C:53 |
3 |
1 |
162 |
cf |
C |
x,y,z |
1_555 |
6 |
1 |
8673 |
62.0 |
-0.2 |
0.645 |
0 |
0 |
0 |
0.002 |
10 |
13 |
|
[PO4]A:53 |
3 |
1 |
162 |
cf |
A |
x,y,z |
1_555 |
5 |
1 |
8504 |
61.9 |
0.1 |
0.672 |
0 |
0 |
0 |
0.000 |
11 |
14 |
|
[PO4]B:53 |
3 |
1 |
161 |
cf |
B |
x,y,z |
1_555 |
5 |
1 |
8673 |
60.8 |
0.1 |
0.664 |
0 |
0 |
0 |
0.000 |
12 |
15 |
|
[PO4]A:0 |
4 |
1 |
177 |
cf |
A |
x,y,z |
1_555 |
5 |
1 |
8504 |
58.4 |
-3.3 |
0.390 |
0 |
0 |
0 |
0.064 |
13 |
16 |
|
[PO4]B:0 |
4 |
1 |
176 |
cf |
B |
x,y,z |
1_555 |
6 |
1 |
8673 |
58.0 |
-2.9 |
0.475 |
0 |
0 |
0 |
0.105 |
14 |
17 |
|
[PO4]C:0 |
4 |
1 |
175 |
cf |
C |
x,y,z |
1_555 |
6 |
1 |
8673 |
57.0 |
-2.8 |
0.471 |
0 |
0 |
0 |
0.027 |
15 |
18 |
|
[PO4]C:53 |
2 |
1 |
162 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
5 |
2 |
8673 |
37.0 |
-0.8 |
0.612 |
1 |
0 |
0 |
0.000 |
16 |
19 |
|
[PO4]B:53 |
2 |
1 |
161 |
◊ |
A |
x,y,z-1 |
1_554 |
5 |
4 |
8504 |
33.8 |
-0.1 |
0.811 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
B |
4 |
3 |
8673 |
◊ |
[PO4]A:53 |
x,y,z-1 |
1_554 |
2 |
1 |
162 |
28.5 |
-0.1 |
0.737 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
[MG]A:102 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
8504 |
26.5 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.094 |
22 |
|
[MG]A:102 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
8673 |
19.5 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.094 |
Average: |
23.0 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.094 |
19 |
23 |
|
A |
5 |
2 |
8504 |
◊ |
A |
-x,y,-z+1 |
2_556 |
5 |
2 |
8504 |
25.0 |
-0.8 |
0.595 |
0 |
0 |
0 |
0.000 |
20 |
24 |
|
[MG]A:102 |
1 |
1 |
98 |
◊ |
[PO4]A:0 |
x,y,z |
1_555 |
2 |
1 |
177 |
20.9 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.051 |
21 |
25 |
|
[MG]A:102 |
1 |
1 |
98 |
◊ |
[PO4]B:0 |
x,y,z |
1_555 |
1 |
1 |
176 |
16.9 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.041 |
22 |
26 |
|
[PO4]C:0 |
1 |
1 |
175 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
1 |
1 |
8673 |
8.6 |
-0.9 |
0.393 |
0 |
0 |
0 |
0.009 |
23 |
27 |
|
[PO4]B:0 |
1 |
1 |
176 |
◊ |
[PO4]A:0 |
x,y,z |
1_555 |
1 |
1 |
177 |
7.7 |
-0.8 |
0.750 |
0 |
0 |
0 |
0.016 |
24 |
28 |
|
[PO4]C:0 |
1 |
1 |
175 |
◊ |
[PO4]C:0 |
-x+1,y,-z+2 |
2_657 |
1 |
1 |
175 |
6.5 |
-0.7 |
0.750 |
0 |
0 |
0 |
0.003 |
25 |
29 |
|
[PO4]A:53 |
1 |
1 |
162 |
◊ |
C |
x-1/2,y+1/2,z |
3_455 |
1 |
1 |
8673 |
0.7 |
-0.1 |
0.480 |
0 |
0 |
0 |
0.000 |
|