## |
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 |
129 |
31 |
5838 |
◊ |
C |
-x+2,y,-z+1 |
2_756 |
128 |
31 |
5838 |
1384.3 |
-29.4 |
0.133 |
4 |
0 |
0 |
0.595 |
2 |
2 |
|
B |
124 |
31 |
5435 |
◊ |
A |
x,y,z |
1_555 |
127 |
31 |
5383 |
1340.3 |
-29.4 |
0.270 |
4 |
0 |
0 |
0.773 |
3 |
3 |
|
C |
37 |
12 |
5838 |
◊ |
A |
x,y,z |
1_555 |
41 |
9 |
5383 |
367.5 |
-6.9 |
0.418 |
1 |
2 |
0 |
0.034 |
4 |
4 |
|
B |
29 |
9 |
5435 |
◊ |
C |
-x+5/2,y-1/2,-z+1 |
4_746 |
43 |
10 |
5838 |
336.4 |
-6.6 |
0.373 |
0 |
0 |
0 |
0.012 |
5 |
5 |
|
B |
34 |
8 |
5435 |
◊ |
A |
-x+5/2,y-1/2,-z+2 |
4_747 |
23 |
7 |
5383 |
292.3 |
-5.0 |
0.343 |
2 |
0 |
0 |
0.000 |
6 |
6 |
|
A |
24 |
5 |
5383 |
◊ |
C |
-x+5/2,y-1/2,-z+1 |
4_746 |
25 |
7 |
5838 |
205.6 |
-1.2 |
0.789 |
2 |
4 |
0 |
0.005 |
7 |
7 |
|
C |
17 |
4 |
5838 |
◊ |
A |
-x+2,y,-z+1 |
2_756 |
16 |
4 |
5383 |
146.6 |
-1.0 |
0.741 |
2 |
4 |
0 |
0.000 |
8 |
8 |
|
B |
13 |
4 |
5435 |
x |
B |
-x+5/2,y-1/2,-z+2 |
4_747 |
12 |
5 |
5435 |
113.6 |
0.2 |
0.817 |
2 |
4 |
0 |
0.000 |
9 |
9 |
|
C |
9 |
4 |
5838 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
5435 |
101.8 |
-1.6 |
0.464 |
1 |
0 |
0 |
0.000 |
10 |
|
C |
1 |
1 |
5838 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
3 |
1 |
5435 |
6.7 |
-0.0 |
0.737 |
0 |
0 |
0 |
0.000 |
Average: |
54.3 |
-0.8 |
0.600 |
1 |
0 |
0 |
0.000 |
10 |
11 |
|
[EDO]A:502 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
5383 |
77.7 |
2.1 |
0.309 |
0 |
0 |
0 |
0.000 |
11 |
12 |
|
B |
8 |
4 |
5435 |
◊ |
[GAI]B:502 |
-x+5/2,y-1/2,-z+2 |
4_747 |
4 |
1 |
188 |
74.0 |
0.4 |
0.516 |
1 |
0 |
0 |
0.000 |
12 |
13 |
|
[EDO]A:502 |
4 |
1 |
183 |
f |
C |
-x+2,y,-z+1 |
2_756 |
11 |
4 |
5838 |
72.1 |
0.9 |
0.716 |
0 |
0 |
0 |
0.000 |
13 |
14 |
|
[GAI]B:501 |
4 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
5435 |
71.2 |
0.2 |
0.442 |
0 |
0 |
0 |
0.000 |
14 |
15 |
|
[GAI]B:502 |
4 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
5435 |
63.5 |
-0.6 |
0.274 |
0 |
0 |
0 |
0.015 |
15 |
16 |
|
[EDO]B:503 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
2 |
5383 |
59.6 |
1.5 |
0.931 |
1 |
0 |
0 |
0.000 |
16 |
17 |
|
[EDO]A:504 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
5383 |
58.4 |
2.6 |
0.984 |
2 |
0 |
0 |
0.000 |
17 |
18 |
|
[EDO]A:504 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
5435 |
53.4 |
0.9 |
0.877 |
0 |
0 |
0 |
0.000 |
18 |
19 |
|
[EDO]B:503 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
5435 |
50.9 |
0.9 |
0.895 |
3 |
0 |
0 |
0.011 |
19 |
20 |
|
[GAI]B:501 |
3 |
1 |
188 |
◊ |
C |
-x+5/2,y-1/2,-z+1 |
4_746 |
10 |
4 |
5838 |
49.3 |
0.2 |
0.400 |
0 |
0 |
0 |
0.000 |
20 |
21 |
|
[SO4]C:501 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
5838 |
46.9 |
-4.6 |
0.966 |
2 |
0 |
0 |
0.211 |
21 |
22 |
|
[SO4]C:501 |
4 |
1 |
185 |
f |
C |
-x+2,y,-z+1 |
2_756 |
4 |
2 |
5838 |
45.7 |
-6.0 |
0.779 |
0 |
0 |
0 |
0.228 |
22 |
23 |
|
[SO4]A:501 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
5383 |
45.0 |
-4.4 |
0.972 |
3 |
0 |
0 |
0.142 |
23 |
24 |
|
[EDO]A:503 |
3 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
5435 |
40.6 |
0.0 |
0.672 |
0 |
0 |
0 |
0.000 |
24 |
25 |
|
[EDO]A:503 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
5383 |
39.8 |
1.8 |
0.961 |
1 |
0 |
0 |
0.000 |
25 |
26 |
|
[SO4]A:501 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
5435 |
38.0 |
-4.9 |
0.692 |
0 |
0 |
0 |
0.122 |
26 |
27 |
|
[GAI]B:501 |
3 |
1 |
188 |
f |
[SO4]A:501 |
x,y,z |
1_555 |
2 |
1 |
184 |
30.6 |
-4.0 |
0.458 |
1 |
0 |
0 |
0.109 |
27 |
28 |
|
[GAI]B:501 |
2 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
5383 |
19.3 |
1.0 |
0.702 |
0 |
0 |
0 |
0.000 |
28 |
29 |
|
C |
3 |
1 |
5838 |
◊ |
A |
-x+5/2,y-1/2,-z+2 |
4_747 |
3 |
2 |
5383 |
16.8 |
-0.9 |
0.376 |
0 |
0 |
0 |
0.000 |
29 |
30 |
|
[EDO]A:504 |
2 |
1 |
184 |
f |
[EDO]A:503 |
x,y,z |
1_555 |
2 |
1 |
185 |
12.4 |
0.7 |
1.000 |
0 |
0 |
0 |
0.000 |
30 |
31 |
|
C |
1 |
1 |
5838 |
◊ |
[GAI]B:502 |
x,y,z-1 |
1_554 |
1 |
1 |
188 |
4.9 |
0.1 |
0.645 |
0 |
0 |
0 |
0.000 |
31 |
32 |
|
[SO4]C:501 |
1 |
1 |
185 |
◊ |
A |
-x+2,y,-z+1 |
2_756 |
1 |
1 |
5383 |
3.3 |
-0.4 |
0.905 |
0 |
0 |
0 |
0.002 |
32 |
33 |
|
[SO4]A:501 |
1 |
1 |
184 |
◊ |
C |
-x+5/2,y-1/2,-z+1 |
4_746 |
1 |
1 |
5838 |
1.9 |
-0.3 |
0.888 |
0 |
0 |
0 |
0.000 |
|