## |
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 |
189 |
42 |
12265 |
◊ |
A |
x,y,z |
1_555 |
192 |
51 |
17930 |
1750.0 |
-8.2 |
0.453 |
30 |
20 |
0 |
0.583 |
2 |
|
B |
175 |
43 |
12265 |
x |
B |
-y+1,x-y,z |
2_655 |
154 |
41 |
12265 |
1601.5 |
-17.4 |
0.085 |
15 |
5 |
0 |
1.000 |
3 |
|
A |
156 |
37 |
17930 |
x |
A |
-y+1,x-y,z |
2_655 |
159 |
41 |
17930 |
1460.2 |
-14.0 |
0.158 |
22 |
8 |
0 |
0.522 |
4 |
|
B |
49 |
20 |
12265 |
◊ |
A |
-x+1,-y+1,z-1/2 |
4_664 |
65 |
25 |
17930 |
502.0 |
-1.6 |
0.497 |
2 |
0 |
0 |
0.000 |
5 |
|
A |
25 |
10 |
17930 |
◊ |
B |
-y+1,x-y,z |
2_655 |
26 |
6 |
12265 |
203.4 |
0.4 |
0.686 |
1 |
2 |
0 |
0.004 |
6 |
|
[3NT]A:1442 |
10 |
1 |
289 |
f |
A |
x,y,z |
1_555 |
36 |
16 |
17930 |
186.0 |
5.0 |
0.346 |
1 |
0 |
0 |
0.000 |
7 |
|
[EDO]B:1197 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
26 |
8 |
12265 |
120.4 |
3.8 |
0.647 |
3 |
0 |
0 |
0.000 |
8 |
|
[FES]A:1440 |
4 |
1 |
236 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
17930 |
117.6 |
-15.5 |
0.632 |
2 |
0 |
0 |
0.389 |
9 |
|
[EDO]A:1444 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
17930 |
102.4 |
5.6 |
0.608 |
5 |
0 |
0 |
0.000 |
10 |
|
[EOH]B:1201 |
3 |
1 |
174 |
◊ |
B |
x,y,z |
1_555 |
16 |
5 |
12265 |
97.8 |
4.0 |
0.328 |
1 |
0 |
0 |
0.000 |
11 |
|
[EOH]B:1200 |
3 |
1 |
172 |
◊ |
B |
x,y,z |
1_555 |
17 |
7 |
12265 |
87.0 |
3.2 |
0.290 |
1 |
0 |
0 |
0.000 |
12 |
|
[EOH]A:1450 |
3 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
18 |
8 |
17930 |
87.0 |
3.2 |
0.292 |
1 |
0 |
0 |
0.000 |
13 |
|
[EOH]A:1446 |
3 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
19 |
11 |
17930 |
84.5 |
2.3 |
0.372 |
1 |
0 |
0 |
0.000 |
14 |
|
[EDO]A:1445 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
19 |
9 |
17930 |
80.2 |
2.0 |
0.594 |
3 |
0 |
0 |
0.000 |
15 |
|
[EOH]A:1447 |
3 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
18 |
8 |
17930 |
80.1 |
3.7 |
0.536 |
0 |
0 |
0 |
0.000 |
16 |
|
[EDO]B:1199 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
12 |
6 |
12265 |
79.6 |
2.2 |
0.268 |
0 |
0 |
0 |
0.000 |
17 |
|
[EDO]A:1443 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
12265 |
78.8 |
2.2 |
0.379 |
2 |
0 |
0 |
0.000 |
18 |
|
[EOH]B:1202 |
3 |
1 |
172 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
12265 |
78.2 |
3.3 |
0.167 |
1 |
0 |
0 |
0.000 |
19 |
|
[EOH]A:1448 |
3 |
1 |
171 |
◊ |
A |
x,y,z |
1_555 |
12 |
4 |
17930 |
72.4 |
2.4 |
0.164 |
2 |
0 |
0 |
0.000 |
20 |
|
[FE]A:1441 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
17930 |
64.4 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.293 |
21 |
|
[EDO]B:1198 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
12265 |
63.4 |
1.3 |
0.760 |
2 |
0 |
0 |
0.000 |
22 |
|
[EOH]A:1449 |
3 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
17930 |
63.4 |
1.5 |
0.000 |
2 |
0 |
0 |
0.000 |
23 |
|
[NI]B:1195 |
1 |
1 |
115 |
cf |
B |
x,y,z |
1_555 |
11 |
5 |
12265 |
61.9 |
-10.5 |
0.000 |
0 |
0 |
0 |
1.000 |
24 |
|
[EOH]B:1203 |
3 |
1 |
172 |
◊ |
B |
x,y,z |
1_555 |
11 |
3 |
12265 |
61.9 |
2.1 |
0.000 |
2 |
0 |
0 |
0.000 |
25 |
|
[EOH]A:1449 |
3 |
1 |
172 |
◊ |
B |
-y+1,x-y,z |
2_655 |
11 |
4 |
12265 |
55.0 |
2.3 |
0.156 |
0 |
0 |
0 |
0.000 |
26 |
|
[EDO]B:1198 |
4 |
1 |
185 |
◊ |
A |
-x+1,-y+1,z-1/2 |
4_664 |
10 |
3 |
17930 |
54.7 |
1.6 |
0.260 |
0 |
0 |
0 |
0.000 |
27 |
|
[EDO]A:1443 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
17930 |
54.5 |
1.3 |
0.739 |
2 |
0 |
0 |
0.000 |
28 |
|
[EOH]B:1203 |
3 |
1 |
172 |
f |
A |
-x+1,-y+1,z-1/2 |
4_664 |
8 |
3 |
17930 |
53.7 |
1.8 |
0.893 |
2 |
0 |
0 |
0.000 |
29 |
|
B |
10 |
4 |
12265 |
◊ |
[EDO]B:1199 |
-y+1,x-y,z |
2_655 |
3 |
1 |
184 |
49.1 |
1.9 |
0.260 |
0 |
0 |
0 |
0.000 |
30 |
|
B |
6 |
4 |
12265 |
f |
[EOH]B:1201 |
-y+1,x-y,z |
2_655 |
3 |
1 |
174 |
44.5 |
1.5 |
0.902 |
1 |
0 |
0 |
0.000 |
31 |
|
B |
5 |
3 |
12265 |
f |
[EOH]B:1200 |
-y+1,x-y,z |
2_655 |
3 |
1 |
172 |
43.6 |
0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
32 |
|
[NI]B:1196 |
1 |
1 |
115 |
f |
B |
-y+1,x-y,z |
2_655 |
8 |
3 |
12265 |
37.9 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.515 |
33 |
|
B |
5 |
2 |
12265 |
f |
[EOH]A:1448 |
-x+1,-y+1,z-1/2 |
4_664 |
2 |
1 |
171 |
36.0 |
1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
34 |
|
B |
5 |
2 |
12265 |
f |
[EOH]A:1450 |
-x+1,-y+1,z-1/2 |
4_664 |
3 |
1 |
172 |
35.4 |
1.0 |
0.863 |
1 |
0 |
0 |
0.000 |
35 |
|
[EDO]A:1445 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
12265 |
33.1 |
1.3 |
0.952 |
2 |
0 |
0 |
0.000 |
36 |
|
[EDO]B:1198 |
3 |
1 |
185 |
◊ |
B |
-y+1,x-y,z |
2_655 |
6 |
2 |
12265 |
33.1 |
-0.0 |
0.591 |
1 |
0 |
0 |
0.020 |
37 |
|
[NI]B:1196 |
1 |
1 |
115 |
◊ |
[EDO]B:1198 |
x,y,z |
1_555 |
4 |
1 |
185 |
33.0 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.151 |
38 |
|
[NI]B:1196 |
1 |
1 |
115 |
◊ |
B |
x,y,z |
1_555 |
7 |
5 |
12265 |
32.1 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.114 |
39 |
|
[EOH]A:1446 |
3 |
1 |
172 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
12265 |
30.6 |
1.4 |
0.925 |
0 |
0 |
0 |
0.000 |
40 |
|
[EOH]A:1446 |
3 |
1 |
172 |
f |
[EDO]A:1445 |
x,y,z |
1_555 |
4 |
1 |
185 |
28.6 |
1.3 |
1.000 |
1 |
0 |
0 |
0.000 |
41 |
|
[3NT]A:1442 |
7 |
1 |
289 |
f |
[FE]A:1441 |
x,y,z |
1_555 |
1 |
1 |
137 |
25.9 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.050 |
42 |
|
[EOH]A:1447 |
2 |
1 |
172 |
◊ |
B |
-y+1,x-y,z |
2_655 |
3 |
1 |
12265 |
25.3 |
1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
43 |
|
B |
4 |
2 |
12265 |
◊ |
A |
x-y+1,x,z-1/2 |
6_654 |
4 |
2 |
17930 |
24.3 |
0.3 |
0.726 |
0 |
0 |
0 |
0.000 |
44 |
|
[EDO]B:1199 |
3 |
1 |
184 |
fx |
[EDO]B:1199 |
-y+1,x-y,z |
2_655 |
2 |
1 |
184 |
23.4 |
0.7 |
1.000 |
1 |
0 |
0 |
0.000 |
45 |
|
[EOH]A:1447 |
1 |
1 |
172 |
f |
[EDO]A:1445 |
x,y,z |
1_555 |
4 |
1 |
185 |
22.5 |
1.5 |
0.577 |
0 |
0 |
0 |
0.000 |
46 |
|
[EOH]A:1449 |
3 |
1 |
172 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
12265 |
19.5 |
0.6 |
0.689 |
0 |
0 |
0 |
0.000 |
47 |
|
A |
4 |
3 |
17930 |
x |
A |
-x+1,-y+1,z-1/2 |
4_664 |
5 |
2 |
17930 |
18.6 |
0.5 |
0.765 |
0 |
0 |
0 |
0.000 |
48 |
|
[FES]A:1440 |
3 |
1 |
236 |
◊ |
A |
-y+1,x-y,z |
2_655 |
4 |
2 |
17930 |
15.5 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.029 |
49 |
|
[NI]B:1196 |
1 |
1 |
115 |
◊ |
A |
-x+1,-y+1,z-1/2 |
4_664 |
2 |
1 |
17930 |
10.9 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
50 |
|
B |
1 |
1 |
12265 |
◊ |
A |
x,y,z-1 |
1_554 |
1 |
1 |
17930 |
10.6 |
0.3 |
0.863 |
0 |
0 |
0 |
0.000 |
51 |
|
[EOH]A:1447 |
1 |
1 |
172 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
12265 |
1.9 |
0.0 |
0.663 |
0 |
0 |
0 |
0.000 |
52 |
|
[EDO]A:1444 |
1 |
1 |
184 |
f |
A |
-y+1,x-y,z |
2_655 |
1 |
1 |
17930 |
0.5 |
0.0 |
0.825 |
0 |
0 |
0 |
0.000 |
|