## |
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 |
|
C |
53 |
6 |
2696 |
◊ |
A |
x,y,z |
1_555 |
63 |
18 |
4962 |
525.8 |
-9.3 |
0.430 |
14 |
0 |
0 |
0.453 |
2 |
2 |
|
C |
41 |
10 |
2696 |
◊ |
B |
x,y,z |
1_555 |
46 |
9 |
2427 |
417.5 |
-5.8 |
0.614 |
23 |
0 |
0 |
1.000 |
3 |
3 |
|
D |
39 |
10 |
4868 |
◊ |
A |
x,y,z-1 |
1_554 |
40 |
10 |
4962 |
367.4 |
-12.4 |
0.031 |
2 |
0 |
0 |
0.148 |
4 |
4 |
|
C |
33 |
4 |
2696 |
◊ |
D |
x,y,z |
1_555 |
36 |
11 |
4868 |
321.0 |
-7.2 |
0.352 |
9 |
0 |
0 |
0.358 |
5 |
5 |
|
B |
24 |
5 |
2427 |
◊ |
A |
x,y,z |
1_555 |
29 |
10 |
4962 |
245.6 |
-3.4 |
0.490 |
6 |
0 |
0 |
0.110 |
6 |
6 |
|
A |
23 |
8 |
4962 |
x |
A |
x-1,y,z |
1_455 |
20 |
5 |
4962 |
203.2 |
-1.1 |
0.560 |
1 |
0 |
0 |
0.000 |
7 |
|
D |
20 |
4 |
4868 |
x |
D |
x-1,y,z |
1_455 |
23 |
7 |
4868 |
192.2 |
-2.6 |
0.405 |
1 |
0 |
0 |
0.000 |
Average: |
197.7 |
-1.8 |
0.483 |
1 |
0 |
0 |
0.000 |
7 |
8 |
|
[5CM]B:6 |
19 |
1 |
449 |
cf |
B |
x,y,z |
1_555 |
26 |
2 |
2427 |
201.5 |
3.5 |
0.616 |
0 |
0 |
0 |
0.000 |
8 |
9 |
|
[5CM]B:6 |
13 |
1 |
449 |
◊ |
A |
x,y,z |
1_555 |
20 |
7 |
4962 |
160.4 |
1.5 |
0.502 |
1 |
0 |
0 |
0.000 |
9 |
10 |
|
D |
19 |
8 |
4868 |
◊ |
B |
x,y-1,z |
1_545 |
20 |
3 |
2427 |
159.3 |
-3.3 |
0.479 |
4 |
0 |
0 |
0.074 |
10 |
11 |
|
B |
14 |
1 |
2427 |
x |
B |
x,y-1,z |
1_545 |
14 |
1 |
2427 |
104.8 |
2.6 |
0.812 |
0 |
0 |
0 |
0.000 |
11 |
12 |
|
C |
13 |
1 |
2696 |
x |
C |
x,y-1,z |
1_545 |
13 |
1 |
2696 |
98.0 |
0.9 |
0.749 |
0 |
0 |
0 |
0.000 |
12 |
13 |
|
C |
11 |
2 |
2696 |
◊ |
B |
x,y-1,z |
1_545 |
11 |
2 |
2427 |
91.4 |
-1.9 |
0.477 |
1 |
0 |
0 |
0.068 |
13 |
14 |
|
D |
15 |
7 |
4868 |
◊ |
[EDO]B:101 |
x,y-1,z |
1_545 |
4 |
1 |
183 |
80.0 |
2.7 |
0.302 |
0 |
0 |
0 |
0.000 |
14 |
15 |
|
[5CM]B:6 |
7 |
1 |
449 |
◊ |
C |
x,y,z |
1_555 |
10 |
3 |
2696 |
73.6 |
-0.2 |
0.471 |
5 |
0 |
0 |
0.157 |
15 |
16 |
|
A |
6 |
1 |
4962 |
◊ |
D |
x-1,y,z+1 |
1_456 |
6 |
1 |
4868 |
57.3 |
-0.2 |
0.600 |
0 |
0 |
0 |
0.003 |
16 |
17 |
|
[EDO]B:101 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
2427 |
52.4 |
0.4 |
0.753 |
2 |
0 |
0 |
0.032 |
17 |
18 |
|
D |
6 |
3 |
4868 |
f |
[ZN]A:201 |
x,y,z-1 |
1_554 |
1 |
1 |
98 |
40.1 |
-20.1 |
0.000 |
0 |
0 |
0 |
0.642 |
19 |
|
[ZN]D:201 |
1 |
1 |
98 |
f |
A |
x,y,z-1 |
1_554 |
5 |
3 |
4962 |
38.4 |
-19.1 |
0.000 |
0 |
0 |
0 |
0.642 |
Average: |
39.3 |
-19.6 |
0.000 |
0 |
0 |
0 |
0.642 |
18 |
20 |
|
D |
2 |
1 |
4868 |
◊ |
C |
x,y-1,z |
1_545 |
7 |
2 |
2696 |
39.2 |
0.1 |
0.627 |
1 |
0 |
0 |
0.003 |
19 |
21 |
|
A |
6 |
1 |
4962 |
◊ |
[ZN]D:202 |
x-1,y,z+1 |
1_456 |
1 |
1 |
98 |
38.6 |
-19.1 |
0.000 |
0 |
0 |
0 |
0.492 |
22 |
|
[ZN]D:202 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
4868 |
37.3 |
-18.4 |
0.000 |
0 |
0 |
0 |
0.492 |
Average: |
37.9 |
-18.8 |
0.000 |
0 |
0 |
0 |
0.492 |
20 |
23 |
|
[ZN]A:201 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
4962 |
37.0 |
-19.3 |
0.000 |
0 |
0 |
0 |
0.418 |
24 |
|
[ZN]D:201 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
4868 |
35.9 |
-18.4 |
0.000 |
0 |
0 |
0 |
0.418 |
Average: |
36.5 |
-18.8 |
0.000 |
0 |
0 |
0 |
0.418 |
21 |
25 |
|
C |
1 |
1 |
2696 |
◊ |
[EDO]B:101 |
x,y-1,z |
1_545 |
1 |
1 |
183 |
8.4 |
-0.4 |
0.429 |
0 |
0 |
0 |
0.011 |
|