| ## |
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 |
|
H |
195 |
53 |
11875 |
◊ |
L |
x,y,z |
1_555 |
190 |
57 |
11142 |
1657.2 |
-24.2 |
0.062 |
16 |
1 |
0 |
1.000 |
| 2 |
2 |
|
C |
145 |
37 |
7195 |
x |
C |
-y+2,x,z |
3_755 |
130 |
31 |
7195 |
1248.0 |
-24.5 |
0.626 |
6 |
1 |
0 |
0.999 |
| 3 |
3 |
|
H |
65 |
17 |
11875 |
◊ |
C |
x,y,z |
1_555 |
62 |
15 |
7195 |
613.6 |
0.2 |
0.879 |
8 |
5 |
0 |
0.000 |
| 4 |
4 |
|
L |
44 |
10 |
11142 |
◊ |
C |
x,y,z |
1_555 |
43 |
11 |
7195 |
388.9 |
-0.2 |
0.757 |
5 |
4 |
0 |
0.000 |
| 5 |
5 |
|
H |
35 |
9 |
11875 |
x |
H |
-x+3/2,-y+3/2,z-1/2 |
6_664 |
48 |
18 |
11875 |
359.9 |
-3.0 |
0.583 |
4 |
0 |
0 |
0.000 |
| 6 |
6 |
|
H |
27 |
10 |
11875 |
◊ |
L |
-x+3/2,-y+3/2,z-1/2 |
6_664 |
31 |
14 |
11142 |
238.2 |
-0.9 |
0.627 |
0 |
0 |
0 |
0.000 |
| 7 |
7 |
|
H |
17 |
4 |
11875 |
◊ |
L |
-y+2,x,z |
3_755 |
19 |
8 |
11142 |
168.7 |
-0.7 |
0.589 |
2 |
0 |
0 |
0.000 |
| 8 |
8 |
|
L |
14 |
6 |
11142 |
◊ |
C |
-y+2,x,z+1 |
3_756 |
18 |
5 |
7195 |
153.9 |
0.2 |
0.665 |
1 |
0 |
0 |
0.000 |
| 9 |
9 |
|
C |
9 |
3 |
7195 |
◊ |
L |
-y+2,x,z |
3_755 |
21 |
9 |
11142 |
118.1 |
-1.5 |
0.473 |
2 |
0 |
0 |
0.000 |
| 10 |
10 |
|
L |
9 |
3 |
11142 |
x |
L |
-y+2,x,z |
3_755 |
11 |
5 |
11142 |
76.8 |
0.9 |
0.738 |
4 |
0 |
0 |
0.000 |
| 11 |
11 |
|
[RB]C:201 |
1 |
1 |
216 |
x |
C |
x,y,z |
1_555 |
7 |
4 |
7195 |
62.9 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.088 |
| 12 |
12 |
|
[RB]C:203 |
1 |
1 |
216 |
f |
[RB]C:202 |
x,y,z |
1_555 |
1 |
1 |
216 |
61.3 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.055 |
| 13 |
13 |
|
[RB]C:202 |
1 |
1 |
216 |
x |
C |
x,y,z |
1_555 |
9 |
4 |
7195 |
59.2 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.173 |
14 |
|
[RB]C:203 |
1 |
1 |
216 |
x |
C |
x,y,z |
1_555 |
9 |
3 |
7195 |
54.5 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.173 |
| Average: |
56.8 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.173 |
| 14 |
15 |
|
C |
4 |
1 |
7195 |
◊ |
H |
-y+2,x,z |
3_755 |
5 |
3 |
11875 |
43.5 |
0.8 |
0.523 |
0 |
0 |
0 |
0.000 |
| 15 |
16 |
|
[RB]C:202 |
1 |
1 |
216 |
f |
[RB]C:201 |
x,y,z |
1_555 |
1 |
1 |
216 |
37.0 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.033 |
| 16 |
17 |
|
L |
4 |
1 |
11142 |
◊ |
H |
-x+3/2,-y+3/2,z-1/2 |
6_664 |
3 |
1 |
11875 |
30.3 |
-0.1 |
0.549 |
1 |
0 |
0 |
0.000 |
| 17 |
18 |
|
[RB]C:204 |
1 |
1 |
216 |
x |
C |
x,y,z |
1_555 |
7 |
5 |
7195 |
25.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.038 |
| 18 |
19 |
|
C |
8 |
7 |
7195 |
◊ |
C |
-x+2,-y+2,z |
2_775 |
8 |
7 |
7195 |
15.4 |
-0.1 |
0.841 |
0 |
0 |
0 |
0.001 |
| 19 |
20 |
|
[RB]C:204 |
1 |
1 |
216 |
f |
[RB]C:203 |
x,y,z |
1_555 |
1 |
1 |
216 |
12.9 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.012 |
| 20 |
21 |
|
L |
2 |
2 |
11142 |
x |
L |
-x+3/2,-y+3/2,z-1/2 |
6_664 |
1 |
1 |
11142 |
10.5 |
0.2 |
0.772 |
0 |
0 |
0 |
0.000 |
| 21 |
22 |
|
C |
1 |
1 |
7195 |
◊ |
L |
x,y,z-1 |
1_554 |
1 |
1 |
11142 |
1.2 |
-0.0 |
0.542 |
0 |
0 |
0 |
0.000 |
|