## |
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 |
621 |
149 |
27893 |
◊ |
A |
x,y,z |
1_555 |
598 |
147 |
28131 |
5832.1 |
-63.9 |
0.041 |
74 |
10 |
0 |
0.282 |
2 |
2 |
|
B |
72 |
21 |
27893 |
x |
B |
-x+2,y-1/2,-z+2 |
2_747 |
67 |
18 |
27893 |
588.2 |
-2.6 |
0.644 |
3 |
4 |
0 |
0.000 |
3 |
3 |
|
A |
57 |
24 |
28131 |
◊ |
B |
-x+2,y-1/2,-z+1 |
2_746 |
63 |
26 |
27893 |
565.7 |
-2.4 |
0.571 |
6 |
2 |
0 |
0.000 |
4 |
4 |
|
[MS1]B:1001 |
42 |
1 |
1076 |
f |
B |
x,y,z |
1_555 |
49 |
16 |
27893 |
405.0 |
-3.3 |
0.289 |
9 |
0 |
0 |
0.039 |
5 |
|
[MS1]A:1002 |
43 |
1 |
1078 |
f |
A |
x,y,z |
1_555 |
49 |
17 |
28131 |
399.4 |
-2.7 |
0.329 |
8 |
0 |
0 |
0.039 |
Average: |
402.2 |
-3.0 |
0.309 |
9 |
0 |
0 |
0.039 |
5 |
6 |
|
[MS1]A:1002 |
43 |
1 |
1078 |
◊ |
B |
x,y,z |
1_555 |
53 |
21 |
27893 |
400.4 |
1.9 |
0.631 |
3 |
0 |
0 |
0.002 |
7 |
|
[MS1]B:1001 |
40 |
1 |
1076 |
◊ |
A |
x,y,z |
1_555 |
50 |
19 |
28131 |
396.3 |
0.8 |
0.563 |
5 |
0 |
0 |
0.002 |
Average: |
398.4 |
1.4 |
0.597 |
4 |
0 |
0 |
0.002 |
6 |
8 |
|
A |
40 |
15 |
28131 |
x |
A |
x-1,y,z |
1_455 |
34 |
11 |
28131 |
363.5 |
0.1 |
0.739 |
3 |
4 |
0 |
0.000 |
9 |
|
B |
36 |
11 |
27893 |
x |
B |
x-1,y,z |
1_455 |
31 |
11 |
27893 |
312.6 |
-0.5 |
0.683 |
2 |
4 |
0 |
0.000 |
Average: |
338.1 |
-0.2 |
0.711 |
3 |
4 |
0 |
0.000 |
7 |
10 |
|
B |
38 |
13 |
27893 |
◊ |
A |
x-1,y,z |
1_455 |
46 |
14 |
28131 |
350.6 |
-1.0 |
0.568 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
29 |
9 |
28131 |
◊ |
B |
x,y,z-1 |
1_554 |
29 |
7 |
27893 |
210.4 |
-0.8 |
0.633 |
1 |
0 |
0 |
0.000 |
9 |
12 |
|
[PO4]B:1006 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
27893 |
115.8 |
-6.2 |
0.817 |
9 |
0 |
0 |
0.029 |
10 |
13 |
|
A |
16 |
4 |
28131 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
13 |
4 |
27893 |
109.4 |
-0.4 |
0.612 |
0 |
1 |
0 |
0.000 |
11 |
14 |
|
[K]B:1003 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
7 |
6 |
27893 |
108.2 |
-107.6 |
0.000 |
0 |
0 |
0 |
0.615 |
15 |
|
[K]A:1004 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
5 |
5 |
28131 |
107.4 |
-106.9 |
0.000 |
0 |
0 |
0 |
0.615 |
Average: |
107.8 |
-107.2 |
0.000 |
0 |
0 |
0 |
0.615 |
12 |
16 |
|
[PO4]A:1005 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
21 |
10 |
28131 |
100.7 |
-6.1 |
0.751 |
7 |
0 |
0 |
0.026 |
13 |
17 |
|
A |
6 |
4 |
28131 |
x |
A |
x,y,z-1 |
1_554 |
11 |
5 |
28131 |
53.8 |
-1.4 |
0.265 |
0 |
0 |
0 |
0.000 |
14 |
18 |
|
B |
2 |
2 |
27893 |
◊ |
[MS1]B:1001 |
x-1,y,z |
1_455 |
7 |
1 |
1076 |
33.4 |
1.0 |
0.656 |
0 |
0 |
0 |
0.000 |
19 |
|
[MS1]A:1002 |
2 |
1 |
1078 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
1 |
28131 |
13.9 |
-0.1 |
0.433 |
0 |
0 |
0 |
0.000 |
Average: |
23.6 |
0.5 |
0.544 |
0 |
0 |
0 |
0.000 |
15 |
20 |
|
A |
4 |
3 |
28131 |
x |
A |
-x+2,y-1/2,-z+2 |
2_747 |
5 |
4 |
28131 |
28.1 |
-0.3 |
0.488 |
0 |
0 |
0 |
0.000 |
16 |
21 |
|
B |
3 |
1 |
27893 |
◊ |
A |
x,y,z-1 |
1_554 |
3 |
1 |
28131 |
25.9 |
0.6 |
0.843 |
1 |
0 |
0 |
0.000 |
17 |
22 |
|
[MS1]A:1002 |
3 |
1 |
1078 |
◊ |
[MS1]B:1001 |
x-1,y,z |
1_455 |
3 |
1 |
1076 |
17.5 |
0.2 |
0.450 |
0 |
0 |
0 |
0.000 |
18 |
23 |
|
[K]A:1004 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
27893 |
2.6 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.006 |
24 |
|
[K]B:1003 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
28131 |
1.7 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.006 |
Average: |
2.2 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.006 |
|