## |
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 |
190 |
50 |
11851 |
◊ |
L |
x,y,z |
1_555 |
200 |
58 |
11774 |
1785.4 |
-27.8 |
0.025 |
15 |
4 |
1 |
1.000 |
2 |
|
X |
76 |
23 |
6431 |
◊ |
L |
x,y,z |
1_555 |
68 |
18 |
11774 |
671.6 |
-4.0 |
0.432 |
10 |
4 |
0 |
0.000 |
3 |
|
P |
29 |
9 |
1141 |
◊ |
L |
x,y,z |
1_555 |
42 |
10 |
11774 |
331.5 |
-5.8 |
0.443 |
4 |
0 |
0 |
0.157 |
4 |
|
H |
37 |
13 |
11851 |
◊ |
X |
x-1/2,y+1/2,z |
3_455 |
35 |
9 |
6431 |
318.0 |
-0.2 |
0.690 |
5 |
0 |
0 |
0.000 |
5 |
|
P |
32 |
9 |
1141 |
◊ |
H |
x,y,z |
1_555 |
41 |
10 |
11851 |
307.5 |
-3.1 |
0.676 |
5 |
0 |
0 |
0.109 |
6 |
|
X |
32 |
11 |
6431 |
◊ |
H |
-x,y,-z+1 |
2_556 |
28 |
11 |
11851 |
253.0 |
-0.7 |
0.609 |
2 |
0 |
0 |
0.000 |
7 |
|
L |
21 |
8 |
11774 |
◊ |
X |
-x,y-1,-z+1 |
2_546 |
24 |
10 |
6431 |
220.8 |
-1.6 |
0.355 |
2 |
1 |
0 |
0.000 |
8 |
|
H |
24 |
11 |
11851 |
◊ |
L |
x,y-1,z |
1_545 |
21 |
9 |
11774 |
206.6 |
-0.7 |
0.594 |
3 |
0 |
0 |
0.000 |
9 |
|
L |
24 |
10 |
11774 |
x |
L |
-x-1/2,y-1/2,-z |
4_445 |
23 |
11 |
11774 |
200.9 |
-0.3 |
0.510 |
2 |
0 |
0 |
0.000 |
10 |
|
H |
21 |
7 |
11851 |
◊ |
X |
-x,y-1,-z+1 |
2_546 |
21 |
5 |
6431 |
192.1 |
-2.2 |
0.348 |
2 |
0 |
0 |
0.000 |
11 |
|
H |
17 |
7 |
11851 |
◊ |
H |
-x-1,y,-z |
2_455 |
17 |
7 |
11851 |
182.3 |
0.8 |
0.788 |
2 |
0 |
0 |
0.000 |
12 |
|
X |
23 |
5 |
6431 |
◊ |
P |
-x-1/2,y-1/2,-z |
4_445 |
21 |
8 |
1141 |
181.4 |
0.1 |
0.898 |
3 |
0 |
0 |
0.000 |
13 |
|
H |
15 |
5 |
11851 |
◊ |
X |
x-1/2,y-1/2,z |
3_445 |
13 |
5 |
6431 |
120.1 |
2.5 |
0.888 |
2 |
0 |
0 |
0.000 |
14 |
|
[EDO]L:301 |
4 |
1 |
183 |
◊ |
L |
x,y,z |
1_555 |
12 |
6 |
11774 |
96.4 |
2.8 |
0.479 |
3 |
0 |
0 |
0.000 |
15 |
|
[EDO]H:302 |
4 |
1 |
183 |
◊ |
H |
x,y,z |
1_555 |
18 |
7 |
11851 |
83.5 |
2.1 |
0.445 |
4 |
0 |
0 |
0.000 |
16 |
|
[EDO]H:301 |
4 |
1 |
184 |
◊ |
H |
x,y,z |
1_555 |
14 |
7 |
11851 |
81.9 |
2.0 |
0.430 |
1 |
0 |
0 |
0.000 |
17 |
|
[EDO]H:301 |
4 |
1 |
184 |
f |
L |
x,y,z |
1_555 |
14 |
6 |
11774 |
73.0 |
1.1 |
0.683 |
1 |
0 |
0 |
0.000 |
18 |
|
[EDO]L:302 |
4 |
1 |
183 |
f |
L |
x,y,z |
1_555 |
8 |
3 |
11774 |
66.3 |
1.9 |
0.903 |
4 |
0 |
0 |
0.000 |
19 |
|
X |
5 |
4 |
6431 |
◊ |
L |
-x-1/2,y-1/2,-z |
4_445 |
7 |
3 |
11774 |
54.0 |
-0.4 |
0.473 |
0 |
0 |
0 |
0.000 |
20 |
|
L |
4 |
2 |
11774 |
◊ |
L |
-x,y,-z+1 |
2_556 |
4 |
2 |
11774 |
53.0 |
2.4 |
0.953 |
0 |
0 |
0 |
0.000 |
21 |
|
[EDO]H:302 |
4 |
1 |
183 |
◊ |
L |
x,y,z |
1_555 |
8 |
3 |
11774 |
52.6 |
0.5 |
0.448 |
0 |
0 |
0 |
0.000 |
22 |
|
L |
7 |
3 |
11774 |
◊ |
X |
x,y-1,z |
1_545 |
5 |
3 |
6431 |
50.4 |
1.2 |
0.754 |
1 |
0 |
0 |
0.000 |
23 |
|
H |
6 |
3 |
11851 |
x |
H |
x,y-1,z |
1_545 |
8 |
4 |
11851 |
50.3 |
0.5 |
0.769 |
0 |
0 |
0 |
0.000 |
24 |
|
P |
4 |
1 |
1141 |
◊ |
H |
-x-1,y,-z |
2_455 |
6 |
2 |
11851 |
44.0 |
-1.1 |
0.395 |
0 |
0 |
0 |
0.000 |
25 |
|
[EDO]L:301 |
4 |
1 |
183 |
◊ |
X |
x,y,z |
1_555 |
4 |
2 |
6431 |
42.4 |
1.5 |
0.765 |
0 |
0 |
0 |
0.000 |
26 |
|
H |
3 |
2 |
11851 |
◊ |
L |
-x-1/2,y-1/2,-z |
4_445 |
8 |
5 |
11774 |
40.8 |
0.6 |
0.774 |
0 |
0 |
0 |
0.000 |
27 |
|
X |
6 |
2 |
6431 |
◊ |
H |
-x-1/2,y-1/2,-z |
4_445 |
5 |
2 |
11851 |
40.1 |
-0.7 |
0.405 |
0 |
0 |
0 |
0.000 |
28 |
|
L |
2 |
1 |
11774 |
◊ |
H |
-x-1/2,y-1/2,-z+1 |
4_446 |
2 |
2 |
11851 |
32.1 |
0.5 |
0.810 |
0 |
0 |
0 |
0.000 |
29 |
|
[EDO]L:302 |
2 |
1 |
183 |
◊ |
P |
x,y,z |
1_555 |
1 |
1 |
1141 |
27.8 |
0.4 |
0.518 |
0 |
0 |
0 |
0.000 |
30 |
|
X |
3 |
1 |
6431 |
◊ |
[EDO]L:302 |
-x-1/2,y-1/2,-z |
4_445 |
2 |
1 |
183 |
27.6 |
0.3 |
0.471 |
0 |
0 |
0 |
0.000 |
31 |
|
[EDO]H:302 |
1 |
1 |
183 |
f |
P |
x,y,z |
1_555 |
2 |
1 |
1141 |
14.4 |
0.2 |
0.510 |
0 |
0 |
0 |
0.000 |
32 |
|
L |
3 |
2 |
11774 |
x |
L |
x,y-1,z |
1_545 |
2 |
2 |
11774 |
9.6 |
-0.1 |
0.466 |
0 |
0 |
0 |
0.000 |
33 |
|
[EDO]L:301 |
1 |
1 |
183 |
f |
L |
-x-1/2,y-1/2,-z |
4_445 |
2 |
1 |
11774 |
1.7 |
0.0 |
0.761 |
0 |
0 |
0 |
0.000 |
|