| ## |
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 |
|
H |
194 |
53 |
11632 |
◊ |
L |
x,y,z |
1_555 |
201 |
60 |
11918 |
1811.5 |
-25.7 |
0.059 |
13 |
3 |
0 |
0.972 |
2 |
|
L |
42 |
14 |
11918 |
◊ |
H |
-x+1,y-1/2,-z+1 |
2_646 |
44 |
16 |
11632 |
419.3 |
1.8 |
0.646 |
3 |
0 |
0 |
0.000 |
3 |
|
L |
47 |
14 |
11918 |
◊ |
H |
-x,y-1/2,-z |
2_545 |
38 |
11 |
11632 |
355.4 |
1.8 |
0.838 |
7 |
2 |
0 |
0.000 |
4 |
|
L |
33 |
8 |
11918 |
x |
L |
x,y,z-1 |
1_554 |
32 |
11 |
11918 |
315.3 |
5.2 |
0.931 |
13 |
2 |
0 |
0.000 |
5 |
|
[HBC]H:3001 |
21 |
1 |
462 |
f |
H |
x,y,z |
1_555 |
42 |
11 |
11632 |
272.1 |
2.9 |
0.297 |
0 |
0 |
0 |
0.000 |
6 |
|
L |
21 |
8 |
11918 |
◊ |
H |
-x,y-1/2,-z+1 |
2_546 |
24 |
8 |
11632 |
230.7 |
0.3 |
0.687 |
1 |
0 |
0 |
0.000 |
7 |
|
L |
21 |
7 |
11918 |
◊ |
H |
x,y-1,z |
1_545 |
24 |
7 |
11632 |
208.3 |
-2.2 |
0.296 |
0 |
0 |
0 |
0.000 |
8 |
|
H |
17 |
6 |
11632 |
x |
H |
-x,y-1/2,-z |
2_545 |
23 |
8 |
11632 |
183.7 |
-2.6 |
0.323 |
1 |
0 |
0 |
0.000 |
9 |
|
[HBC]H:3001 |
8 |
1 |
462 |
◊ |
L |
x,y,z |
1_555 |
11 |
4 |
11918 |
108.9 |
1.0 |
0.227 |
0 |
0 |
0 |
0.000 |
10 |
|
L |
12 |
5 |
11918 |
◊ |
H |
-x+1,y-1/2,-z+2 |
2_647 |
7 |
3 |
11632 |
74.9 |
0.7 |
0.698 |
0 |
0 |
0 |
0.000 |
11 |
|
[OH]H:4000 |
1 |
1 |
99 |
f |
H |
x,y,z |
1_555 |
9 |
3 |
11632 |
38.5 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.140 |
12 |
|
[HBC]H:3001 |
7 |
1 |
462 |
f |
[OH]H:4000 |
x,y,z |
1_555 |
1 |
1 |
99 |
34.8 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.109 |
13 |
|
L |
3 |
3 |
11918 |
◊ |
H |
x,y,z-1 |
1_554 |
4 |
3 |
11632 |
29.2 |
1.0 |
0.879 |
0 |
0 |
0 |
0.000 |
14 |
|
L |
3 |
2 |
11918 |
x |
L |
-x,y-1/2,-z+1 |
2_546 |
3 |
2 |
11918 |
23.7 |
0.7 |
0.834 |
0 |
1 |
0 |
0.000 |
15 |
|
H |
1 |
1 |
11632 |
x |
H |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
1 |
11632 |
16.4 |
0.1 |
0.611 |
0 |
0 |
0 |
0.000 |
16 |
|
H |
2 |
1 |
11632 |
◊ |
L |
-x,y-1/2,-z |
2_545 |
1 |
1 |
11918 |
3.6 |
-0.1 |
0.452 |
0 |
0 |
0 |
0.000 |
|