## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
L |
112 |
31 |
4331 |
◊ |
H |
x,y,z |
1_555 |
102 |
30 |
11675 |
953.1 |
-6.7 |
0.442 |
13 |
6 |
1 |
0.186 |
2 |
|
[70C]H:301 |
45 |
1 |
822 |
f |
H |
x,y,z |
1_555 |
80 |
27 |
11675 |
529.7 |
-1.8 |
0.374 |
6 |
0 |
0 |
0.048 |
3 |
|
L |
46 |
13 |
4331 |
◊ |
H |
-x+1/2,y-1/2,-z+1/4 |
5_545 |
43 |
13 |
11675 |
410.3 |
-3.7 |
0.402 |
5 |
0 |
0 |
0.000 |
4 |
|
H |
23 |
6 |
11675 |
x |
H |
-y+1/2,x+1/2,z+1/4 |
3_555 |
27 |
8 |
11675 |
263.7 |
-2.0 |
0.391 |
2 |
0 |
0 |
0.000 |
5 |
|
H |
26 |
7 |
11675 |
◊ |
H |
y,x,-z |
7_555 |
26 |
7 |
11675 |
252.7 |
-4.0 |
0.188 |
2 |
0 |
0 |
0.024 |
6 |
|
L |
26 |
8 |
4331 |
◊ |
H |
y,x,-z |
7_555 |
22 |
7 |
11675 |
218.0 |
0.6 |
0.711 |
5 |
3 |
0 |
0.020 |
7 |
|
L |
19 |
6 |
4331 |
◊ |
L |
-y,-x,-z+1/2 |
8_555 |
19 |
6 |
4331 |
151.0 |
0.1 |
0.700 |
4 |
0 |
0 |
0.000 |
8 |
|
[GOL]H:306 |
6 |
1 |
221 |
f |
H |
x,y,z |
1_555 |
23 |
10 |
11675 |
133.1 |
-1.2 |
0.449 |
1 |
0 |
0 |
0.018 |
9 |
|
[GOL]H:307 |
6 |
1 |
217 |
f |
H |
x,y,z |
1_555 |
19 |
9 |
11675 |
133.0 |
-1.0 |
0.457 |
3 |
0 |
0 |
0.025 |
10 |
|
[SO4]H:303 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
14 |
5 |
11675 |
102.6 |
-16.3 |
0.732 |
4 |
0 |
0 |
0.194 |
11 |
|
[SO4]H:304 |
5 |
1 |
184 |
f |
H |
x,y,z |
1_555 |
14 |
6 |
11675 |
97.8 |
-16.5 |
0.730 |
3 |
0 |
0 |
0.190 |
12 |
|
[SO4]H:305 |
5 |
1 |
186 |
f |
H |
x,y,z |
1_555 |
12 |
5 |
11675 |
82.2 |
-11.6 |
0.805 |
2 |
0 |
0 |
0.134 |
13 |
|
[SO4]H:305 |
5 |
1 |
186 |
◊ |
L |
x,y,z |
1_555 |
8 |
2 |
4331 |
50.1 |
-6.1 |
0.859 |
0 |
0 |
0 |
0.065 |
14 |
|
[GOL]H:307 |
5 |
1 |
217 |
◊ |
L |
x,y,z |
1_555 |
2 |
2 |
4331 |
47.2 |
-1.0 |
0.145 |
0 |
0 |
0 |
0.011 |
15 |
|
H |
3 |
1 |
11675 |
◊ |
[GOL]H:306 |
-y+1/2,x+1/2,z+1/4 |
3_555 |
3 |
1 |
221 |
44.2 |
0.6 |
0.660 |
1 |
0 |
0 |
0.000 |
16 |
|
[CA]H:302 |
1 |
1 |
85 |
f |
H |
x,y,z |
1_555 |
8 |
6 |
11675 |
44.1 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.131 |
17 |
|
[SO4]H:303 |
2 |
1 |
185 |
◊ |
L |
y,x,-z |
7_555 |
3 |
1 |
4331 |
18.8 |
-2.1 |
0.853 |
0 |
0 |
0 |
0.020 |
18 |
|
[SO4]H:303 |
1 |
1 |
185 |
◊ |
H |
y,x,-z |
7_555 |
1 |
1 |
11675 |
17.1 |
-2.4 |
0.342 |
0 |
0 |
0 |
0.023 |
|