## |
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 |
141 |
40 |
12884 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
149 |
39 |
13109 |
1317.9 |
-10.4 |
0.376 |
10 |
0 |
0 |
0.046 |
2 |
2 |
|
[P7D]A:505 |
22 |
1 |
563 |
f |
A |
x,y,z |
1_555 |
48 |
19 |
13109 |
301.8 |
-8.1 |
0.299 |
2 |
0 |
0 |
0.053 |
3 |
|
[P7D]B:504 |
23 |
1 |
568 |
f |
B |
x,y,z |
1_555 |
45 |
17 |
12884 |
285.7 |
-7.2 |
0.272 |
2 |
0 |
0 |
0.053 |
Average: |
293.8 |
-7.7 |
0.286 |
2 |
0 |
0 |
0.053 |
3 |
4 |
|
B |
37 |
13 |
12884 |
◊ |
A |
x,y,z |
1_555 |
40 |
13 |
13109 |
295.2 |
-1.6 |
0.560 |
1 |
0 |
0 |
0.000 |
4 |
5 |
|
A |
23 |
8 |
13109 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
31 |
13 |
13109 |
227.5 |
0.0 |
0.601 |
0 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
17 |
4 |
12884 |
x |
B |
x-1/2,-y-1/2,-z-1 |
4_444 |
16 |
5 |
12884 |
158.0 |
0.1 |
0.616 |
2 |
0 |
0 |
0.000 |
6 |
7 |
|
[P7D]B:504 |
12 |
1 |
568 |
◊ |
A |
x,y,z |
1_555 |
23 |
7 |
13109 |
139.7 |
-2.9 |
0.619 |
1 |
0 |
0 |
0.000 |
7 |
8 |
|
B |
14 |
4 |
12884 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
14 |
6 |
13109 |
135.4 |
2.3 |
0.916 |
4 |
8 |
0 |
0.000 |
8 |
9 |
|
[K]A:504 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
13109 |
116.4 |
-108.2 |
0.000 |
0 |
0 |
0 |
0.667 |
10 |
|
[K]B:503 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
15 |
9 |
12884 |
115.4 |
-108.2 |
0.000 |
0 |
0 |
0 |
0.667 |
Average: |
115.9 |
-108.2 |
0.000 |
0 |
0 |
0 |
0.667 |
9 |
11 |
|
[EDO]B:505 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
12884 |
109.6 |
3.2 |
0.459 |
1 |
0 |
0 |
0.000 |
10 |
12 |
|
[EDO]A:506 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
17 |
7 |
13109 |
103.3 |
2.5 |
0.289 |
2 |
0 |
0 |
0.000 |
11 |
13 |
|
[EDO]B:506 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
19 |
10 |
12884 |
101.6 |
3.1 |
0.511 |
2 |
0 |
0 |
0.000 |
12 |
14 |
|
[P7D]A:505 |
8 |
1 |
563 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
12884 |
97.6 |
-2.5 |
0.543 |
0 |
0 |
0 |
0.000 |
13 |
15 |
|
B |
5 |
2 |
12884 |
◊ |
A |
x-1,y,z |
1_455 |
5 |
2 |
13109 |
49.0 |
1.4 |
0.907 |
1 |
2 |
0 |
0.000 |
14 |
16 |
|
B |
5 |
3 |
12884 |
x |
B |
-x,y-1/2,-z-1/2 |
3_544 |
7 |
2 |
12884 |
45.0 |
-0.9 |
0.320 |
0 |
0 |
0 |
0.000 |
15 |
17 |
|
B |
3 |
2 |
12884 |
◊ |
[EDO]A:506 |
-x+1/2,-y,z-1/2 |
2_554 |
2 |
1 |
183 |
37.4 |
0.5 |
0.268 |
0 |
0 |
0 |
0.000 |
16 |
18 |
|
[ZN]A:502 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
13109 |
35.8 |
-26.0 |
0.000 |
0 |
0 |
0 |
0.158 |
19 |
|
[ZN]B:501 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
12884 |
35.3 |
-25.3 |
0.000 |
0 |
0 |
0 |
0.158 |
Average: |
35.6 |
-25.7 |
0.000 |
0 |
0 |
0 |
0.158 |
17 |
20 |
|
[P7D]A:505 |
4 |
1 |
563 |
cf |
[ZN]A:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.9 |
-14.6 |
0.000 |
0 |
0 |
0 |
0.092 |
21 |
|
[P7D]B:504 |
5 |
1 |
568 |
f |
[ZN]B:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.5 |
-15.2 |
0.000 |
0 |
0 |
0 |
0.092 |
Average: |
30.7 |
-14.9 |
0.000 |
0 |
0 |
0 |
0.092 |
18 |
22 |
|
[EDO]B:506 |
3 |
1 |
185 |
f |
[P7D]B:504 |
x,y,z |
1_555 |
1 |
1 |
568 |
17.0 |
0.1 |
0.707 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
B |
1 |
1 |
12884 |
f |
[EDO]A:506 |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
183 |
2.1 |
0.1 |
0.864 |
0 |
0 |
0 |
0.000 |
|