## |
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 |
171 |
49 |
11184 |
◊ |
A |
x,y,z |
1_555 |
175 |
52 |
11240 |
1627.6 |
-23.8 |
0.124 |
17 |
1 |
0 |
1.000 |
2 |
|
H |
173 |
51 |
11136 |
◊ |
L |
x,y,z |
1_555 |
172 |
52 |
11373 |
1607.0 |
-23.1 |
0.149 |
18 |
1 |
0 |
1.000 |
Average: |
1617.3 |
-23.4 |
0.136 |
18 |
1 |
0 |
1.000 |
2 |
3 |
|
A |
57 |
18 |
11240 |
◊ |
L |
-y+1,x-y,z+1 |
2_656 |
59 |
18 |
11373 |
547.7 |
-4.5 |
0.428 |
6 |
0 |
0 |
0.161 |
3 |
4 |
|
H |
63 |
24 |
11136 |
◊ |
B |
x,y,z-1 |
1_554 |
59 |
23 |
11184 |
529.7 |
-5.1 |
0.620 |
7 |
0 |
0 |
0.071 |
4 |
5 |
|
L |
42 |
13 |
11373 |
◊ |
A |
x,y,z-1 |
1_554 |
43 |
15 |
11240 |
442.5 |
-1.3 |
0.640 |
6 |
8 |
0 |
0.116 |
5 |
6 |
|
B |
36 |
11 |
11184 |
◊ |
B |
y,x,-z+2 |
4_557 |
36 |
11 |
11184 |
384.8 |
-1.4 |
0.779 |
10 |
0 |
0 |
0.003 |
6 |
7 |
|
H |
27 |
9 |
11136 |
◊ |
H |
y,x,-z |
4_555 |
27 |
9 |
11136 |
259.4 |
-1.7 |
0.666 |
4 |
0 |
0 |
0.002 |
7 |
8 |
|
B |
19 |
7 |
11184 |
◊ |
A |
y,x,-z+2 |
4_557 |
18 |
4 |
11240 |
146.5 |
-1.7 |
0.484 |
0 |
0 |
0 |
0.002 |
8 |
9 |
|
H |
12 |
4 |
11136 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
11184 |
136.5 |
-0.6 |
0.653 |
5 |
0 |
0 |
0.000 |
9 |
10 |
|
A |
12 |
6 |
11240 |
x |
A |
-y+1,x-y,z |
2_655 |
18 |
7 |
11240 |
119.3 |
-0.6 |
0.655 |
1 |
0 |
0 |
0.045 |
11 |
|
L |
19 |
7 |
11373 |
x |
L |
-y+1,x-y,z |
2_655 |
15 |
7 |
11373 |
114.9 |
-0.5 |
0.673 |
1 |
0 |
0 |
0.045 |
Average: |
117.1 |
-0.6 |
0.664 |
1 |
0 |
0 |
0.045 |
10 |
12 |
|
[SO4]A:303 |
5 |
1 |
185 |
fx |
[SO4]A:303 |
-y+1,x-y,z |
2_655 |
5 |
1 |
185 |
79.2 |
-17.9 |
0.993 |
0 |
0 |
0 |
0.570 |
13 |
|
[SO4]L:301 |
5 |
1 |
185 |
fx |
[SO4]L:301 |
-y+1,x-y,z |
2_655 |
5 |
1 |
185 |
56.5 |
-12.6 |
0.967 |
0 |
0 |
0 |
0.570 |
14 |
|
[SO4]L:302 |
5 |
1 |
190 |
fx |
[SO4]L:302 |
-y+1,x-y,z |
2_655 |
5 |
1 |
190 |
45.5 |
-10.2 |
0.993 |
0 |
0 |
0 |
0.570 |
Average: |
60.4 |
-13.6 |
0.985 |
0 |
0 |
0 |
0.570 |
11 |
15 |
|
L |
3 |
2 |
11373 |
◊ |
B |
x,y,z-1 |
1_554 |
6 |
3 |
11184 |
41.4 |
-0.1 |
0.629 |
1 |
0 |
0 |
0.005 |
16 |
|
H |
1 |
1 |
11136 |
◊ |
A |
x,y,z-1 |
1_554 |
1 |
1 |
11240 |
2.3 |
-0.1 |
0.427 |
0 |
0 |
0 |
0.005 |
Average: |
21.9 |
-0.1 |
0.528 |
1 |
0 |
0 |
0.005 |
12 |
17 |
|
H |
3 |
1 |
11136 |
◊ |
L |
y,x,-z |
4_555 |
6 |
1 |
11373 |
38.5 |
-0.8 |
0.289 |
0 |
0 |
0 |
0.000 |
13 |
18 |
|
[SO4]A:303 |
4 |
1 |
185 |
◊ |
A |
-y+1,x-y,z |
2_655 |
5 |
3 |
11240 |
29.8 |
-3.8 |
0.927 |
1 |
0 |
0 |
0.135 |
14 |
19 |
|
A |
5 |
3 |
11240 |
◊ |
[SO4]A:303 |
-y+1,x-y,z |
2_655 |
4 |
1 |
185 |
28.8 |
-3.8 |
0.922 |
1 |
0 |
0 |
0.134 |
15 |
20 |
|
[SO4]A:303 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
11240 |
27.5 |
-3.5 |
0.936 |
1 |
0 |
0 |
0.128 |
16 |
21 |
|
[SO4]L:302 |
3 |
1 |
190 |
◊ |
L |
x,y,z |
1_555 |
7 |
3 |
11373 |
24.7 |
-2.4 |
0.919 |
2 |
0 |
0 |
0.072 |
17 |
22 |
|
L |
7 |
3 |
11373 |
◊ |
[SO4]L:302 |
-y+1,x-y,z |
2_655 |
3 |
1 |
190 |
24.4 |
-2.3 |
0.916 |
1 |
0 |
0 |
0.061 |
18 |
23 |
|
[SO4]L:302 |
3 |
1 |
190 |
◊ |
L |
-y+1,x-y,z |
2_655 |
7 |
3 |
11373 |
24.0 |
-2.2 |
0.920 |
2 |
0 |
0 |
0.069 |
19 |
24 |
|
[SO4]L:301 |
2 |
1 |
185 |
◊ |
L |
-y+1,x-y,z |
2_655 |
2 |
2 |
11373 |
17.1 |
-2.0 |
0.454 |
0 |
0 |
0 |
0.045 |
20 |
25 |
|
[SO4]L:301 |
2 |
1 |
185 |
◊ |
L |
x,y,z |
1_555 |
2 |
2 |
11373 |
15.4 |
-1.8 |
0.478 |
0 |
0 |
0 |
0.041 |
21 |
26 |
|
L |
1 |
1 |
11373 |
◊ |
[SO4]L:301 |
-y+1,x-y,z |
2_655 |
1 |
1 |
185 |
14.8 |
-1.8 |
0.335 |
0 |
0 |
0 |
0.039 |
22 |
27 |
|
[SO4]L:302 |
1 |
1 |
190 |
f |
[SO4]L:301 |
-y+1,x-y,z |
2_655 |
4 |
1 |
185 |
10.4 |
-2.3 |
0.894 |
0 |
0 |
0 |
0.050 |
23 |
28 |
|
[SO4]L:301 |
4 |
1 |
185 |
f |
[SO4]L:302 |
-y+1,x-y,z |
2_655 |
1 |
1 |
190 |
10.3 |
-2.2 |
0.894 |
0 |
0 |
0 |
0.049 |
24 |
29 |
|
[SO4]L:302 |
1 |
1 |
190 |
f |
[SO4]L:301 |
x,y,z |
1_555 |
4 |
1 |
185 |
10.2 |
-2.2 |
0.894 |
0 |
0 |
0 |
0.049 |
|