## |
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 |
|
A |
126 |
34 |
21494 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
123 |
33 |
21054 |
1277.2 |
-11.0 |
0.144 |
14 |
12 |
0 |
0.084 |
2 |
2 |
|
A |
59 |
17 |
21494 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
53 |
17 |
21054 |
548.2 |
2.4 |
0.762 |
2 |
2 |
0 |
0.000 |
3 |
3 |
|
[OO5]B:603 |
30 |
1 |
640 |
f |
B |
x,y,z |
1_555 |
67 |
24 |
21054 |
448.5 |
-6.5 |
0.425 |
11 |
0 |
0 |
0.102 |
4 |
|
[OO5]A:603 |
30 |
1 |
636 |
f |
A |
x,y,z |
1_555 |
66 |
24 |
21494 |
446.9 |
-6.7 |
0.426 |
11 |
0 |
0 |
0.102 |
Average: |
447.7 |
-6.6 |
0.425 |
11 |
0 |
0 |
0.102 |
4 |
5 |
|
A |
41 |
13 |
21494 |
◊ |
A |
-x,-y,z |
2_555 |
42 |
13 |
21494 |
435.6 |
0.2 |
0.665 |
8 |
6 |
0 |
0.000 |
5 |
6 |
|
B |
45 |
15 |
21054 |
◊ |
A |
-x+1,-y,z |
2_655 |
39 |
11 |
21494 |
384.2 |
-1.8 |
0.447 |
5 |
0 |
0 |
0.000 |
7 |
|
A |
38 |
13 |
21494 |
◊ |
B |
-x+1,-y,z-1 |
2_654 |
40 |
12 |
21054 |
357.5 |
-0.6 |
0.526 |
5 |
0 |
0 |
0.000 |
Average: |
370.8 |
-1.2 |
0.486 |
5 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
23 |
7 |
21054 |
◊ |
A |
x,y,z |
1_555 |
26 |
8 |
21494 |
195.6 |
-1.0 |
0.396 |
0 |
0 |
0 |
0.000 |
7 |
9 |
|
A |
12 |
5 |
21494 |
x |
A |
x,y,z-1 |
1_554 |
12 |
5 |
21494 |
108.5 |
-1.3 |
0.285 |
0 |
0 |
0 |
0.000 |
10 |
|
B |
13 |
5 |
21054 |
x |
B |
x,y,z-1 |
1_554 |
14 |
5 |
21054 |
107.1 |
-1.5 |
0.282 |
0 |
0 |
0 |
0.000 |
Average: |
107.8 |
-1.4 |
0.283 |
0 |
0 |
0 |
0.000 |
8 |
11 |
|
[CA]A:604 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
6 |
6 |
21494 |
45.9 |
-12.2 |
0.000 |
0 |
0 |
0 |
0.106 |
12 |
|
[CA]B:604 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
6 |
21054 |
45.4 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.106 |
Average: |
45.6 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.106 |
9 |
13 |
|
B |
5 |
1 |
21054 |
◊ |
B |
-x+1,-y,z |
2_655 |
5 |
1 |
21054 |
42.7 |
-0.1 |
0.586 |
0 |
0 |
0 |
0.000 |
10 |
14 |
|
[ZN]A:601 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
7 |
21494 |
35.6 |
-25.5 |
0.000 |
0 |
0 |
0 |
0.222 |
15 |
|
[ZN]B:601 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
8 |
7 |
21054 |
35.4 |
-24.8 |
0.000 |
0 |
0 |
0 |
0.222 |
Average: |
35.5 |
-25.1 |
0.000 |
0 |
0 |
0 |
0.222 |
11 |
16 |
|
[ZN]A:602 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
21494 |
31.8 |
-23.8 |
0.000 |
0 |
0 |
0 |
0.208 |
17 |
|
[ZN]B:602 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
21054 |
31.7 |
-23.4 |
0.000 |
0 |
0 |
0 |
0.208 |
Average: |
31.8 |
-23.6 |
0.000 |
0 |
0 |
0 |
0.208 |
12 |
18 |
|
[OO5]B:603 |
4 |
1 |
640 |
f |
[ZN]B:602 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.7 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.109 |
19 |
|
[OO5]A:603 |
4 |
1 |
636 |
f |
[ZN]A:602 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.6 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.109 |
Average: |
28.7 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.109 |
13 |
20 |
|
[OO5]B:603 |
3 |
1 |
640 |
cf |
[ZN]B:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.1 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.093 |
21 |
|
[OO5]A:603 |
3 |
1 |
636 |
f |
[ZN]A:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
27.9 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.093 |
Average: |
28.0 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.093 |
14 |
22 |
|
B |
1 |
1 |
21054 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
21054 |
11.3 |
0.2 |
0.543 |
0 |
0 |
0 |
0.000 |
15 |
23 |
|
[ZN]B:602 |
1 |
1 |
98 |
f |
[ZN]B:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.2 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.039 |
16 |
24 |
|
[ZN]A:602 |
1 |
1 |
98 |
f |
[ZN]A:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.6 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.037 |
|