| ## |
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 |
|
B |
105 |
30 |
12532 |
◊ |
A |
x,y,z |
1_555 |
108 |
29 |
12858 |
991.5 |
-10.3 |
0.250 |
12 |
0 |
0 |
0.134 |
| 2 |
2 |
|
A |
44 |
14 |
12858 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
40 |
12 |
12532 |
437.3 |
-7.4 |
0.092 |
3 |
0 |
0 |
0.000 |
| 3 |
3 |
|
[E11]B:2003 |
30 |
1 |
735 |
f |
B |
x,y,z |
1_555 |
48 |
17 |
12532 |
389.0 |
-4.9 |
0.826 |
2 |
0 |
0 |
0.050 |
| 4 |
4 |
|
[E11]A:2002 |
33 |
1 |
796 |
f |
A |
x,y,z |
1_555 |
60 |
17 |
12858 |
363.8 |
-5.2 |
0.700 |
1 |
0 |
0 |
0.102 |
5 |
|
[E11]A:2001 |
32 |
1 |
763 |
f |
A |
x,y,z |
1_555 |
57 |
17 |
12858 |
344.3 |
-5.8 |
0.642 |
1 |
0 |
0 |
0.102 |
| Average: |
354.0 |
-5.5 |
0.671 |
1 |
0 |
0 |
0.102 |
| 5 |
6 |
|
A |
46 |
18 |
12858 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
34 |
8 |
12532 |
312.4 |
-0.7 |
0.670 |
0 |
0 |
0 |
0.000 |
| 6 |
7 |
|
[E11]A:2002 |
34 |
1 |
796 |
f |
[E11]A:2001 |
x,y,z |
1_555 |
33 |
1 |
763 |
310.4 |
-5.5 |
0.972 |
0 |
0 |
0 |
0.047 |
| 7 |
8 |
|
A |
34 |
11 |
12858 |
◊ |
B |
x-1,y,z |
1_455 |
25 |
9 |
12532 |
235.4 |
0.1 |
0.671 |
4 |
3 |
0 |
0.000 |
| 8 |
9 |
|
B |
11 |
6 |
12532 |
x |
B |
x-1,y,z |
1_455 |
15 |
6 |
12532 |
116.1 |
-2.2 |
0.242 |
0 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[EDO]B:2 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
22 |
7 |
12532 |
108.9 |
3.4 |
0.514 |
3 |
0 |
0 |
0.000 |
| 10 |
11 |
|
[EDO]B:1 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
12532 |
69.8 |
1.3 |
0.792 |
0 |
0 |
0 |
0.000 |
| 11 |
12 |
|
A |
9 |
3 |
12858 |
◊ |
[EDO]B:1 |
x-1,y,z |
1_455 |
4 |
1 |
184 |
64.0 |
1.5 |
0.213 |
1 |
0 |
0 |
0.000 |
| 12 |
13 |
|
A |
4 |
2 |
12858 |
x |
A |
x-1,y,z |
1_455 |
6 |
2 |
12858 |
48.6 |
-0.4 |
0.475 |
0 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[ZN]A:10 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
12858 |
40.0 |
-26.5 |
0.000 |
0 |
0 |
0 |
0.449 |
15 |
|
[ZN]B:9 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
4 |
12532 |
39.1 |
-25.8 |
0.000 |
0 |
0 |
0 |
0.449 |
| Average: |
39.6 |
-26.2 |
0.000 |
0 |
0 |
0 |
0.449 |
| 14 |
16 |
|
B |
4 |
2 |
12532 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
2 |
12858 |
36.0 |
-0.9 |
0.276 |
0 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[E11]A:2001 |
2 |
1 |
763 |
◊ |
A |
x-1,y,z |
1_455 |
5 |
2 |
12858 |
30.6 |
0.0 |
0.609 |
0 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[ZN]B:9 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
12858 |
28.0 |
-14.8 |
0.000 |
0 |
0 |
0 |
0.245 |
19 |
|
[ZN]A:10 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
12532 |
26.3 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.245 |
| Average: |
27.2 |
-14.3 |
0.000 |
0 |
0 |
0 |
0.245 |
| 17 |
20 |
|
[E11]A:2002 |
2 |
1 |
796 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
1 |
12858 |
17.8 |
0.1 |
0.757 |
0 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[ZN]A:3 |
1 |
1 |
98 |
f |
[ZN]A:2 |
x,y,z |
1_555 |
1 |
1 |
98 |
17.4 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.035 |
| 19 |
22 |
|
[ZN]B:7 |
1 |
1 |
98 |
f |
[ZN]B:5 |
x,y,z |
1_555 |
1 |
1 |
98 |
16.8 |
-13.5 |
0.000 |
0 |
0 |
0 |
0.036 |
| 20 |
23 |
|
[EDO]B:1 |
1 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
12858 |
16.8 |
-0.1 |
0.604 |
0 |
0 |
0 |
0.000 |
| 21 |
24 |
|
[ZN]A:3 |
1 |
1 |
98 |
f |
[ZN]A:1236 |
x,y,z |
1_555 |
1 |
1 |
98 |
16.4 |
-13.1 |
0.000 |
0 |
0 |
0 |
0.033 |
| 22 |
25 |
|
[ZN]A:2 |
1 |
1 |
98 |
f |
[ZN]A:1236 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.4 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.031 |
| 23 |
26 |
|
[ZN]B:7 |
1 |
1 |
98 |
f |
[ZN]B:6 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.3 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.033 |
| 24 |
27 |
|
[ZN]B:6 |
1 |
1 |
98 |
f |
[ZN]B:5 |
x,y,z |
1_555 |
1 |
1 |
98 |
14.5 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.031 |
| 25 |
28 |
|
[E11]A:2001 |
2 |
1 |
763 |
◊ |
[EDO]B:1 |
x-1,y,z |
1_455 |
2 |
1 |
184 |
9.5 |
0.1 |
0.854 |
0 |
0 |
0 |
0.000 |
|