## |
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 |
203 |
56 |
11381 |
◊ |
H |
x,y,z |
1_555 |
178 |
46 |
10839 |
1670.6 |
-24.7 |
0.103 |
15 |
0 |
0 |
1.000 |
2 |
|
H |
60 |
17 |
10839 |
◊ |
L |
x-1/2,-y+1/2,-z |
4_455 |
63 |
19 |
11381 |
547.4 |
-2.7 |
0.652 |
15 |
1 |
0 |
0.000 |
3 |
|
H |
64 |
19 |
10839 |
◊ |
L |
-x-1/2,-y,z-1/2 |
2_454 |
51 |
20 |
11381 |
494.9 |
-1.7 |
0.718 |
7 |
1 |
0 |
0.000 |
4 |
|
H |
24 |
9 |
10839 |
◊ |
L |
x-1/2,-y-1/2,-z |
4_445 |
22 |
8 |
11381 |
200.0 |
-0.1 |
0.715 |
1 |
0 |
0 |
0.000 |
5 |
|
L |
20 |
5 |
11381 |
x |
L |
x-1/2,-y+1/2,-z |
4_455 |
25 |
9 |
11381 |
182.7 |
-1.6 |
0.447 |
1 |
0 |
0 |
0.000 |
6 |
|
H |
20 |
10 |
10839 |
x |
H |
x-1/2,-y-1/2,-z |
4_445 |
18 |
6 |
10839 |
165.9 |
-1.2 |
0.657 |
1 |
0 |
0 |
0.000 |
7 |
|
L |
20 |
8 |
11381 |
x |
L |
-x,y-1/2,-z+1/2 |
3_545 |
18 |
6 |
11381 |
161.6 |
1.7 |
0.773 |
4 |
0 |
0 |
0.000 |
8 |
|
[PEG]L:303 |
7 |
1 |
253 |
◊ |
L |
x,y,z |
1_555 |
20 |
9 |
11381 |
132.7 |
3.8 |
0.429 |
1 |
0 |
0 |
0.000 |
9 |
|
[EDO]L:302 |
4 |
1 |
182 |
f |
L |
x,y,z |
1_555 |
14 |
9 |
11381 |
106.6 |
4.3 |
0.550 |
3 |
0 |
0 |
0.000 |
10 |
|
[EDO]H:303 |
4 |
1 |
186 |
◊ |
H |
x,y,z |
1_555 |
15 |
7 |
10839 |
103.4 |
2.7 |
0.519 |
1 |
0 |
0 |
0.000 |
11 |
|
[EDO]L:305 |
4 |
1 |
183 |
◊ |
L |
x,y,z |
1_555 |
14 |
6 |
11381 |
100.9 |
3.9 |
0.531 |
1 |
0 |
0 |
0.000 |
12 |
|
[EDO]L:304 |
4 |
1 |
184 |
f |
L |
x,y,z |
1_555 |
15 |
6 |
11381 |
81.0 |
2.1 |
0.277 |
3 |
0 |
0 |
0.000 |
13 |
|
[EDO]L:301 |
4 |
1 |
184 |
f |
L |
x,y,z |
1_555 |
9 |
4 |
11381 |
78.0 |
3.2 |
0.968 |
2 |
0 |
0 |
0.000 |
14 |
|
[EDO]L:306 |
4 |
1 |
183 |
◊ |
L |
x,y,z |
1_555 |
13 |
3 |
11381 |
73.6 |
1.9 |
0.279 |
3 |
0 |
0 |
0.000 |
15 |
|
[EDO]H:302 |
4 |
1 |
184 |
◊ |
H |
x,y,z |
1_555 |
11 |
5 |
10839 |
70.3 |
1.6 |
0.275 |
1 |
0 |
0 |
0.000 |
16 |
|
[EDO]H:301 |
4 |
1 |
184 |
◊ |
L |
x,y,z |
1_555 |
14 |
6 |
11381 |
69.5 |
2.1 |
0.432 |
1 |
0 |
0 |
0.000 |
17 |
|
H |
12 |
6 |
10839 |
◊ |
[EDO]H:302 |
x-1/2,-y-1/2,-z |
4_445 |
4 |
1 |
184 |
67.3 |
1.9 |
0.312 |
2 |
0 |
0 |
0.000 |
18 |
|
[EDO]H:301 |
4 |
1 |
184 |
f |
H |
x,y,z |
1_555 |
8 |
4 |
10839 |
65.2 |
1.8 |
0.426 |
3 |
0 |
0 |
0.000 |
19 |
|
L |
9 |
4 |
11381 |
◊ |
H |
x-1/2,-y-1/2,-z |
4_445 |
7 |
6 |
10839 |
58.8 |
-0.9 |
0.414 |
0 |
0 |
0 |
0.000 |
20 |
|
H |
6 |
2 |
10839 |
f |
[PEG]L:303 |
-x-1/2,-y,z-1/2 |
2_454 |
5 |
1 |
253 |
58.4 |
1.1 |
0.249 |
2 |
0 |
0 |
0.000 |
21 |
|
H |
8 |
2 |
10839 |
◊ |
L |
x-1,y,z |
1_455 |
7 |
4 |
11381 |
49.9 |
-1.0 |
0.400 |
0 |
0 |
0 |
0.000 |
22 |
|
H |
5 |
1 |
10839 |
x |
H |
x-1/2,-y+1/2,-z |
4_455 |
3 |
2 |
10839 |
39.0 |
-0.7 |
0.376 |
0 |
0 |
0 |
0.000 |
23 |
|
H |
4 |
2 |
10839 |
f |
[EDO]L:305 |
x-1/2,-y-1/2,-z |
4_445 |
3 |
1 |
183 |
38.3 |
1.1 |
0.959 |
2 |
0 |
0 |
0.000 |
24 |
|
[EDO]L:304 |
3 |
1 |
184 |
◊ |
H |
x,y,z |
1_555 |
4 |
2 |
10839 |
34.6 |
1.3 |
0.931 |
1 |
0 |
0 |
0.000 |
25 |
|
[EDO]L:302 |
4 |
1 |
182 |
f |
[EDO]L:301 |
x,y,z |
1_555 |
3 |
1 |
184 |
29.4 |
1.3 |
1.000 |
0 |
0 |
0 |
0.000 |
26 |
|
H |
3 |
2 |
10839 |
x |
H |
-x-1/2,-y,z-1/2 |
2_454 |
2 |
1 |
10839 |
22.8 |
0.2 |
0.687 |
0 |
0 |
0 |
0.000 |
27 |
|
[EDO]H:303 |
2 |
1 |
186 |
f |
L |
x-1/2,-y+1/2,-z |
4_455 |
3 |
2 |
11381 |
20.7 |
0.2 |
0.714 |
0 |
0 |
0 |
0.000 |
28 |
|
L |
1 |
1 |
11381 |
f |
[EDO]H:302 |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
184 |
6.4 |
0.1 |
0.539 |
0 |
0 |
0 |
0.000 |
29 |
|
[EDO]L:306 |
1 |
1 |
183 |
f |
H |
x,y,z |
1_555 |
1 |
1 |
10839 |
1.0 |
-0.0 |
0.726 |
0 |
0 |
0 |
0.000 |
|