## |
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 |
72 |
18 |
10359 |
x |
B |
-x-1/2,-y,z-1/2 |
2_454 |
75 |
26 |
10359 |
701.5 |
-5.2 |
0.385 |
7 |
4 |
0 |
0.000 |
2 |
2 |
|
B |
62 |
18 |
10359 |
◊ |
A |
x,y,z |
1_555 |
64 |
20 |
10355 |
572.6 |
-4.7 |
0.399 |
1 |
0 |
0 |
0.000 |
3 |
3 |
|
B |
60 |
19 |
10359 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
50 |
16 |
10355 |
485.2 |
1.9 |
0.716 |
6 |
2 |
0 |
0.000 |
4 |
4 |
|
[E8J]A:304 |
30 |
1 |
684 |
f |
A |
x,y,z |
1_555 |
55 |
19 |
10355 |
404.9 |
-8.4 |
0.490 |
5 |
0 |
0 |
0.011 |
5 |
5 |
|
B |
26 |
9 |
10359 |
x |
B |
x,y,z-1 |
1_554 |
27 |
10 |
10359 |
207.3 |
0.1 |
0.648 |
2 |
0 |
0 |
0.000 |
6 |
6 |
|
A |
26 |
9 |
10355 |
x |
A |
-x+1/2,-y,z-1/2 |
2_554 |
21 |
7 |
10355 |
184.4 |
-2.2 |
0.453 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
B |
21 |
5 |
10359 |
◊ |
A |
x,y,z-1 |
1_554 |
14 |
4 |
10355 |
153.5 |
-2.3 |
0.315 |
0 |
0 |
0 |
0.000 |
8 |
8 |
|
[SCN]A:301 |
3 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
10355 |
113.3 |
-2.4 |
0.537 |
0 |
0 |
0 |
0.003 |
9 |
9 |
|
[SCN]B:301 |
3 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
10359 |
107.5 |
-3.2 |
0.464 |
0 |
0 |
0 |
0.007 |
10 |
10 |
|
[SCN]B:303 |
3 |
1 |
181 |
f |
B |
x,y,z |
1_555 |
19 |
6 |
10359 |
100.6 |
-3.4 |
0.423 |
1 |
0 |
0 |
0.008 |
11 |
11 |
|
[E8J]A:304 |
11 |
1 |
684 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
10359 |
92.9 |
-2.1 |
0.451 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
[SCN]B:302 |
3 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
10359 |
76.5 |
-2.9 |
0.510 |
1 |
0 |
0 |
0.007 |
13 |
13 |
|
[ACE]A:-1 |
3 |
1 |
171 |
cf |
A |
x,y,z |
1_555 |
3 |
2 |
10355 |
73.3 |
-1.4 |
0.638 |
1 |
0 |
0 |
0.002 |
14 |
14 |
|
[SCN]B:302 |
3 |
1 |
182 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
15 |
4 |
10359 |
69.0 |
-1.1 |
0.541 |
0 |
0 |
0 |
0.000 |
15 |
15 |
|
[ZN]B:304 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
10359 |
50.0 |
-35.6 |
0.000 |
0 |
0 |
0 |
0.077 |
16 |
|
[ZN]A:302 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
10355 |
36.8 |
-23.9 |
0.000 |
0 |
0 |
0 |
0.077 |
Average: |
43.4 |
-29.8 |
0.000 |
0 |
0 |
0 |
0.077 |
16 |
17 |
|
[ZN]A:303 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
16 |
10 |
10355 |
46.1 |
-29.6 |
0.000 |
0 |
0 |
0 |
0.032 |
17 |
18 |
|
[SCN]A:301 |
3 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
10359 |
41.2 |
-1.4 |
0.278 |
0 |
0 |
0 |
0.000 |
18 |
19 |
|
[SCN]B:303 |
3 |
1 |
181 |
◊ |
B |
x,y,z-1 |
1_554 |
5 |
3 |
10359 |
40.6 |
-0.8 |
0.450 |
0 |
0 |
0 |
0.000 |
19 |
20 |
|
[SCN]B:301 |
3 |
1 |
182 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
1 |
10359 |
38.9 |
-1.0 |
0.438 |
0 |
0 |
0 |
0.000 |
20 |
21 |
|
[E8J]A:304 |
4 |
1 |
684 |
f |
[ZN]A:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
33.5 |
-15.4 |
0.000 |
0 |
0 |
0 |
0.017 |
21 |
22 |
|
[ZN]A:303 |
1 |
1 |
98 |
f |
[ACE]A:-1 |
x,y,z |
1_555 |
2 |
1 |
171 |
24.2 |
-9.3 |
0.000 |
0 |
0 |
0 |
0.010 |
22 |
23 |
|
A |
1 |
1 |
10355 |
x |
A |
x,y,z-1 |
1_554 |
1 |
1 |
10355 |
1.0 |
-0.0 |
0.529 |
0 |
0 |
0 |
0.000 |
|