| ## |
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 |
93 |
25 |
7900 |
◊ |
C |
-x,y,-z-1 |
2_554 |
92 |
25 |
7900 |
900.4 |
-12.2 |
0.160 |
6 |
2 |
0 |
1.000 |
| 2 |
2 |
|
C |
79 |
25 |
7900 |
◊ |
A |
x,y,z |
1_555 |
71 |
19 |
7881 |
754.7 |
-13.4 |
0.065 |
6 |
1 |
0 |
0.521 |
3 |
|
D |
81 |
24 |
7895 |
◊ |
B |
x,y,z |
1_555 |
69 |
19 |
7877 |
720.2 |
-10.5 |
0.165 |
3 |
2 |
0 |
0.521 |
| Average: |
737.4 |
-12.0 |
0.115 |
5 |
2 |
0 |
0.521 |
| 3 |
4 |
|
B |
64 |
21 |
7877 |
◊ |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
60 |
16 |
7881 |
620.9 |
-7.9 |
0.250 |
6 |
0 |
0 |
0.154 |
| 4 |
5 |
|
C |
54 |
20 |
7900 |
◊ |
B |
x,y,z-1 |
1_554 |
56 |
16 |
7877 |
508.8 |
-6.9 |
0.233 |
4 |
0 |
0 |
0.129 |
| 5 |
6 |
|
A |
51 |
19 |
7881 |
◊ |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
48 |
16 |
7877 |
497.0 |
-6.7 |
0.223 |
3 |
0 |
0 |
0.111 |
| 6 |
7 |
|
D |
57 |
19 |
7895 |
◊ |
D |
-x,y,-z |
2_555 |
56 |
19 |
7895 |
467.4 |
-4.5 |
0.421 |
2 |
0 |
0 |
0.000 |
| 7 |
8 |
|
D |
31 |
13 |
7895 |
◊ |
A |
x,y,z |
1_555 |
35 |
10 |
7881 |
318.6 |
-3.8 |
0.277 |
3 |
0 |
0 |
0.071 |
| 8 |
9 |
|
D |
27 |
10 |
7895 |
◊ |
C |
-x,y,-z |
2_555 |
32 |
12 |
7900 |
271.5 |
-1.1 |
0.571 |
1 |
0 |
0 |
0.020 |
| 9 |
10 |
|
A |
16 |
7 |
7881 |
x |
A |
-x+1/2,y-1/2,-z |
4_545 |
19 |
5 |
7881 |
140.9 |
-0.5 |
0.546 |
0 |
0 |
0 |
0.000 |
| 10 |
11 |
|
A |
12 |
4 |
7881 |
◊ |
B |
x,y,z-1 |
1_554 |
12 |
4 |
7877 |
108.8 |
0.1 |
0.654 |
0 |
2 |
0 |
0.003 |
| 11 |
12 |
|
[SO4]A:1203 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
7881 |
80.8 |
-12.4 |
0.625 |
3 |
0 |
0 |
0.442 |
| 12 |
13 |
|
[SO4]B:1203 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
7877 |
68.9 |
-10.3 |
0.610 |
3 |
0 |
0 |
0.431 |
| 13 |
14 |
|
C |
10 |
4 |
7900 |
x |
C |
x,y-1,z |
1_545 |
7 |
4 |
7900 |
47.8 |
-0.3 |
0.568 |
0 |
0 |
0 |
0.000 |
15 |
|
D |
9 |
3 |
7895 |
x |
D |
x,y-1,z |
1_545 |
5 |
4 |
7895 |
38.2 |
0.2 |
0.682 |
0 |
0 |
0 |
0.000 |
| Average: |
43.0 |
-0.0 |
0.625 |
0 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[LI]A:1204 |
1 |
1 |
130 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
7895 |
47.7 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.117 |
| 15 |
17 |
|
[LI]A:1204 |
1 |
1 |
130 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
7881 |
45.3 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.024 |
| 16 |
18 |
|
A |
2 |
1 |
7881 |
◊ |
[SO4]B:1203 |
-x+1/2,y-1/2,-z+1 |
4_546 |
3 |
1 |
186 |
42.0 |
-5.9 |
0.177 |
0 |
0 |
0 |
0.082 |
| 17 |
19 |
|
C |
5 |
2 |
7900 |
◊ |
B |
-x,y,-z |
2_555 |
4 |
2 |
7877 |
32.9 |
-0.8 |
0.348 |
0 |
0 |
0 |
0.010 |
| 18 |
20 |
|
[SO4]A:1203 |
3 |
1 |
187 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
7900 |
12.8 |
-1.1 |
0.903 |
0 |
0 |
0 |
0.036 |
| 19 |
21 |
|
B |
2 |
1 |
7877 |
x |
B |
-x+1/2,y-1/2,-z+1 |
4_546 |
2 |
1 |
7877 |
12.4 |
-0.1 |
0.490 |
0 |
0 |
0 |
0.000 |
| 20 |
22 |
|
D |
1 |
1 |
7895 |
◊ |
A |
-x,y,-z |
2_555 |
1 |
1 |
7881 |
3.1 |
0.0 |
0.551 |
0 |
0 |
0 |
0.000 |
| 21 |
23 |
|
C |
1 |
1 |
7900 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
7881 |
2.2 |
-0.1 |
0.446 |
0 |
0 |
0 |
0.000 |
24 |
|
D |
1 |
1 |
7895 |
◊ |
B |
x,y-1,z |
1_545 |
1 |
1 |
7877 |
0.8 |
-0.0 |
0.535 |
0 |
0 |
0 |
0.000 |
| Average: |
1.5 |
-0.0 |
0.490 |
0 |
0 |
0 |
0.000 |
| 22 |
25 |
|
A |
1 |
1 |
7881 |
x |
A |
x,y-1,z |
1_545 |
1 |
1 |
7881 |
1.3 |
-0.0 |
0.476 |
0 |
0 |
0 |
0.000 |
26 |
|
B |
1 |
1 |
7877 |
x |
B |
x,y-1,z |
1_545 |
1 |
1 |
7877 |
0.3 |
-0.0 |
0.577 |
0 |
0 |
0 |
0.000 |
| Average: |
0.8 |
-0.0 |
0.527 |
0 |
0 |
0 |
0.000 |
|