## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
49 |
18 |
16599 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
61 |
19 |
16599 |
502.3 |
-6.0 |
0.218 |
2 |
2 |
0 |
0.000 |
2 |
|
B |
49 |
16 |
16599 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
34 |
12 |
16599 |
394.1 |
0.8 |
0.741 |
4 |
1 |
0 |
0.000 |
3 |
|
[EDO]B:11 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
20 |
10 |
16599 |
120.7 |
4.0 |
0.534 |
3 |
0 |
0 |
0.000 |
4 |
|
[EDO]B:15 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
10 |
16599 |
115.0 |
3.4 |
0.609 |
3 |
0 |
0 |
0.000 |
5 |
|
[EDO]B:7 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
23 |
7 |
16599 |
112.8 |
3.0 |
0.415 |
1 |
0 |
0 |
0.000 |
6 |
|
[EDO]B:4 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
8 |
16599 |
108.4 |
2.9 |
0.424 |
2 |
0 |
0 |
0.000 |
7 |
|
[EDO]B:19 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
16599 |
108.3 |
3.7 |
0.494 |
2 |
0 |
0 |
0.000 |
8 |
|
[EDO]B:6 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
16599 |
107.4 |
3.4 |
0.525 |
0 |
0 |
0 |
0.000 |
9 |
|
[EDO]B:1 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
23 |
7 |
16599 |
106.3 |
2.5 |
0.423 |
2 |
0 |
0 |
0.000 |
10 |
|
[EDO]B:2 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
23 |
7 |
16599 |
104.9 |
3.7 |
0.488 |
1 |
0 |
0 |
0.000 |
11 |
|
[EDO]B:14 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
16599 |
104.3 |
3.8 |
0.495 |
2 |
0 |
0 |
0.000 |
12 |
|
[EDO]B:13 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
16 |
9 |
16599 |
103.2 |
3.2 |
0.537 |
2 |
0 |
0 |
0.000 |
13 |
|
[EDO]B:17 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
16599 |
95.1 |
2.8 |
0.493 |
4 |
0 |
0 |
0.000 |
14 |
|
[EDO]B:5 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
16599 |
92.2 |
3.4 |
0.547 |
2 |
0 |
0 |
0.000 |
15 |
|
B |
10 |
4 |
16599 |
x |
B |
-x+1,y-1/2,-z-1/2 |
3_644 |
10 |
4 |
16599 |
89.4 |
-0.3 |
0.564 |
4 |
0 |
0 |
0.000 |
16 |
|
[EDO]B:3 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
6 |
16599 |
83.8 |
2.5 |
0.295 |
0 |
0 |
0 |
0.000 |
17 |
|
[EDO]B:9 |
4 |
1 |
182 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
17 |
5 |
16599 |
81.5 |
2.1 |
0.443 |
1 |
0 |
0 |
0.000 |
18 |
|
[EDO]B:16 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
16599 |
80.6 |
1.4 |
0.175 |
0 |
0 |
0 |
0.000 |
19 |
|
[EDO]B:10 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
16599 |
77.5 |
2.4 |
0.317 |
1 |
0 |
0 |
0.000 |
20 |
|
[EDO]B:18 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
16599 |
75.4 |
1.4 |
0.178 |
0 |
0 |
0 |
0.000 |
21 |
|
[EDO]B:20 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
3 |
16599 |
72.8 |
1.6 |
0.229 |
1 |
0 |
0 |
0.000 |
22 |
|
[EDO]B:9 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
16599 |
70.4 |
1.6 |
0.276 |
3 |
0 |
0 |
0.000 |
23 |
|
[EDO]B:8 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
10 |
2 |
16599 |
60.4 |
1.3 |
0.611 |
0 |
0 |
0 |
0.000 |
24 |
|
[EDO]B:10 |
4 |
1 |
185 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
8 |
3 |
16599 |
55.9 |
1.6 |
0.835 |
1 |
0 |
0 |
0.000 |
25 |
|
[EDO]B:8 |
3 |
1 |
185 |
f |
B |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
1 |
16599 |
36.3 |
0.4 |
0.364 |
0 |
0 |
0 |
0.000 |
26 |
|
B |
4 |
2 |
16599 |
x |
B |
-x+1/2,-y,z-1/2 |
2_554 |
2 |
2 |
16599 |
36.1 |
-1.1 |
0.135 |
0 |
0 |
0 |
0.000 |
27 |
|
[EDO]B:4 |
4 |
1 |
185 |
f |
[EDO]B:19 |
x,y,z |
1_555 |
4 |
1 |
183 |
34.0 |
1.6 |
1.000 |
0 |
0 |
0 |
0.000 |
28 |
|
[EDO]B:3 |
1 |
1 |
185 |
f |
[EDO]B:2 |
x,y,z |
1_555 |
2 |
1 |
183 |
17.8 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
29 |
|
B |
3 |
1 |
16599 |
f |
[EDO]B:6 |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
183 |
16.6 |
0.6 |
0.893 |
0 |
0 |
0 |
0.000 |
30 |
|
[EDO]B:15 |
2 |
1 |
185 |
f |
[EDO]B:13 |
x,y,z |
1_555 |
2 |
1 |
183 |
13.2 |
0.9 |
1.000 |
0 |
0 |
0 |
0.000 |
31 |
|
[EDO]B:10 |
1 |
1 |
185 |
f |
[EDO]B:11 |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
185 |
10.7 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
32 |
|
[EDO]B:17 |
1 |
1 |
183 |
f |
[EDO]B:16 |
x,y,z |
1_555 |
1 |
1 |
184 |
9.1 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
|