## |
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 |
|
A |
83 |
23 |
14681 |
x |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
82 |
26 |
14681 |
662.3 |
-4.6 |
0.330 |
6 |
3 |
0 |
0.000 |
2 |
|
A |
57 |
14 |
14681 |
◊ |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
57 |
14 |
14681 |
449.9 |
1.0 |
0.784 |
6 |
10 |
0 |
0.000 |
3 |
|
[A3P]A:401 |
26 |
1 |
578 |
f |
A |
x,y,z |
1_555 |
68 |
23 |
14681 |
387.6 |
-4.3 |
0.602 |
19 |
0 |
0 |
0.000 |
4 |
|
[POL]A:426 |
4 |
1 |
201 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
14681 |
131.5 |
3.9 |
0.293 |
1 |
0 |
0 |
0.000 |
5 |
|
[EDO]A:423 |
4 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
14681 |
123.3 |
3.8 |
0.520 |
2 |
0 |
0 |
0.000 |
6 |
|
A |
10 |
5 |
14681 |
◊ |
A |
y,x,-z |
7_555 |
10 |
5 |
14681 |
121.1 |
-0.4 |
0.536 |
0 |
0 |
0 |
0.000 |
7 |
|
[EDO]A:406 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
20 |
10 |
14681 |
113.8 |
3.7 |
0.638 |
3 |
0 |
0 |
0.000 |
8 |
|
[EDO]A:402 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
14681 |
113.6 |
3.1 |
0.442 |
1 |
0 |
0 |
0.000 |
9 |
|
[EDO]A:411 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
14681 |
109.0 |
3.6 |
0.444 |
2 |
0 |
0 |
0.000 |
10 |
|
[EDO]A:418 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
14681 |
106.5 |
2.3 |
0.273 |
2 |
0 |
0 |
0.000 |
11 |
|
[EDO]A:408 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
11 |
14681 |
104.4 |
2.2 |
0.367 |
0 |
0 |
0 |
0.000 |
12 |
|
[POL]A:424 |
4 |
1 |
201 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
14681 |
104.2 |
3.0 |
0.225 |
1 |
0 |
0 |
0.000 |
13 |
|
[EDO]A:415 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
14681 |
103.6 |
3.5 |
0.494 |
2 |
0 |
0 |
0.000 |
14 |
|
[EDO]A:417 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
14681 |
100.8 |
3.2 |
0.502 |
3 |
0 |
0 |
0.000 |
15 |
|
[EDO]A:422 |
4 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
14681 |
99.5 |
3.0 |
0.446 |
2 |
0 |
0 |
0.000 |
16 |
|
[EDO]A:413 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
14681 |
96.9 |
2.4 |
0.407 |
2 |
0 |
0 |
0.000 |
17 |
|
[EDO]A:409 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
14681 |
96.2 |
2.6 |
0.425 |
0 |
0 |
0 |
0.000 |
18 |
|
[EDO]A:404 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
14681 |
96.1 |
3.0 |
0.459 |
4 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:420 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
14681 |
92.3 |
2.9 |
0.476 |
4 |
0 |
0 |
0.000 |
20 |
|
[EDO]A:419 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
14681 |
90.7 |
2.0 |
0.279 |
3 |
0 |
0 |
0.000 |
21 |
|
[POL]A:428 |
4 |
1 |
205 |
f |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
20 |
8 |
14681 |
89.1 |
2.4 |
0.149 |
0 |
0 |
0 |
0.000 |
22 |
|
[EDO]A:410 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
14681 |
88.9 |
2.6 |
0.492 |
3 |
0 |
0 |
0.000 |
23 |
|
[POL]A:427 |
4 |
1 |
201 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
14681 |
81.7 |
2.5 |
0.136 |
1 |
0 |
0 |
0.000 |
24 |
|
[POL]A:425 |
4 |
1 |
201 |
◊ |
A |
x,y,z |
1_555 |
14 |
4 |
14681 |
81.2 |
2.5 |
0.159 |
0 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:405 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
14681 |
80.2 |
1.5 |
0.374 |
3 |
0 |
0 |
0.000 |
26 |
|
[EDO]A:412 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
14681 |
79.7 |
2.7 |
0.303 |
2 |
0 |
0 |
0.000 |
27 |
|
[POL]A:428 |
4 |
1 |
205 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
14681 |
78.6 |
2.8 |
0.261 |
0 |
0 |
0 |
0.000 |
28 |
|
[EDO]A:414 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
14681 |
78.4 |
2.4 |
0.282 |
1 |
0 |
0 |
0.000 |
29 |
|
[EDO]A:416 |
4 |
1 |
186 |
◊ |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
14 |
5 |
14681 |
73.0 |
2.0 |
0.409 |
1 |
0 |
0 |
0.000 |
30 |
|
A |
11 |
4 |
14681 |
◊ |
[EDO]A:403 |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
4 |
1 |
188 |
68.4 |
1.8 |
0.243 |
1 |
0 |
0 |
0.000 |
31 |
|
A |
13 |
5 |
14681 |
f |
[EDO]A:421 |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
4 |
1 |
182 |
68.3 |
1.5 |
0.247 |
1 |
0 |
0 |
0.000 |
32 |
|
[EDO]A:407 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
13 |
5 |
14681 |
66.1 |
1.7 |
0.443 |
1 |
0 |
0 |
0.000 |
33 |
|
A |
10 |
4 |
14681 |
x |
A |
x-1/2,-y+3/2,-z+1/4 |
6_465 |
9 |
4 |
14681 |
64.3 |
-0.0 |
0.626 |
0 |
0 |
0 |
0.000 |
34 |
|
[EDO]A:407 |
4 |
1 |
182 |
f |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
12 |
6 |
14681 |
63.4 |
1.5 |
0.279 |
1 |
0 |
0 |
0.000 |
35 |
|
[EDO]A:403 |
3 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
14681 |
61.0 |
1.5 |
0.265 |
2 |
0 |
0 |
0.000 |
36 |
|
[EDO]A:421 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
14681 |
60.7 |
1.6 |
0.230 |
1 |
0 |
0 |
0.000 |
37 |
|
[POL]A:427 |
4 |
1 |
201 |
f |
A |
x-1/2,-y+3/2,-z+1/4 |
6_465 |
6 |
2 |
14681 |
55.8 |
1.4 |
0.854 |
0 |
0 |
0 |
0.000 |
38 |
|
[POL]A:425 |
4 |
1 |
201 |
cf |
[EDO]A:416 |
-y+1,-x+1,-z+1/2 |
8_665 |
4 |
1 |
186 |
46.4 |
1.9 |
1.000 |
0 |
0 |
0 |
0.000 |
39 |
|
A |
8 |
3 |
14681 |
◊ |
[EDO]A:405 |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
4 |
1 |
183 |
44.1 |
0.9 |
0.527 |
0 |
0 |
0 |
0.000 |
40 |
|
[POL]A:425 |
4 |
1 |
201 |
◊ |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
3 |
1 |
14681 |
43.6 |
1.6 |
0.948 |
0 |
0 |
0 |
0.000 |
41 |
|
[EDO]A:410 |
4 |
1 |
185 |
f |
[A3P]A:401 |
x,y,z |
1_555 |
4 |
1 |
578 |
39.3 |
0.0 |
0.704 |
2 |
0 |
0 |
0.000 |
42 |
|
[EDO]A:405 |
3 |
1 |
183 |
f |
[EDO]A:403 |
x,y,z |
1_555 |
3 |
1 |
188 |
29.7 |
1.3 |
1.000 |
0 |
0 |
0 |
0.000 |
43 |
|
[EDO]A:410 |
2 |
1 |
185 |
f |
[EDO]A:408 |
x,y,z |
1_555 |
3 |
1 |
184 |
29.0 |
1.8 |
0.707 |
0 |
0 |
0 |
0.000 |
44 |
|
[EDO]A:416 |
2 |
1 |
186 |
f |
[EDO]A:413 |
-y+1,-x+1,-z+1/2 |
8_665 |
2 |
1 |
184 |
26.2 |
1.6 |
0.707 |
0 |
0 |
0 |
0.000 |
45 |
|
[EDO]A:420 |
2 |
1 |
182 |
f |
[EDO]A:409 |
x,y,z |
1_555 |
2 |
1 |
184 |
26.1 |
0.8 |
1.000 |
1 |
0 |
0 |
0.000 |
46 |
|
[EDO]A:409 |
2 |
1 |
184 |
f |
[EDO]A:404 |
x,y,z |
1_555 |
2 |
1 |
183 |
25.1 |
1.5 |
1.000 |
0 |
0 |
0 |
0.000 |
47 |
|
[EDO]A:423 |
3 |
1 |
188 |
f |
[EDO]A:408 |
x,y,z |
1_555 |
2 |
1 |
184 |
24.0 |
1.3 |
1.000 |
0 |
0 |
0 |
0.000 |
48 |
|
[EDO]A:407 |
2 |
1 |
182 |
◊ |
[EDO]A:421 |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
2 |
1 |
182 |
22.6 |
1.3 |
0.707 |
0 |
0 |
0 |
0.000 |
49 |
|
[EDO]A:413 |
3 |
1 |
184 |
◊ |
[EDO]A:412 |
x,y,z |
1_555 |
2 |
1 |
185 |
20.9 |
1.3 |
1.000 |
0 |
0 |
0 |
0.000 |
50 |
|
[EDO]A:420 |
2 |
1 |
182 |
f |
[EDO]A:418 |
x,y,z |
1_555 |
3 |
1 |
185 |
20.2 |
1.3 |
1.000 |
0 |
0 |
0 |
0.000 |
51 |
|
[EDO]A:416 |
1 |
1 |
186 |
◊ |
[EDO]A:412 |
-y+1,-x+1,-z+1/2 |
8_665 |
2 |
1 |
185 |
17.4 |
0.8 |
1.000 |
0 |
0 |
0 |
0.000 |
52 |
|
[EDO]A:416 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
14681 |
14.5 |
0.4 |
0.871 |
0 |
0 |
0 |
0.000 |
53 |
|
[EDO]A:420 |
1 |
1 |
182 |
f |
[EDO]A:404 |
x,y,z |
1_555 |
2 |
1 |
183 |
14.3 |
0.6 |
1.000 |
0 |
0 |
0 |
0.000 |
54 |
|
[POL]A:425 |
1 |
1 |
201 |
f |
[EDO]A:413 |
x,y,z |
1_555 |
1 |
1 |
184 |
12.8 |
0.6 |
1.000 |
0 |
0 |
0 |
0.000 |
55 |
|
[POL]A:425 |
1 |
1 |
201 |
◊ |
[EDO]A:412 |
x,y,z |
1_555 |
1 |
1 |
185 |
8.7 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
56 |
|
[EDO]A:412 |
1 |
1 |
185 |
f |
A |
-y+1,-x+1,-z+1/2 |
8_665 |
4 |
2 |
14681 |
8.4 |
0.1 |
0.798 |
0 |
0 |
0 |
0.000 |
57 |
|
[EDO]A:412 |
2 |
1 |
185 |
◊ |
[EDO]A:412 |
-y+1,-x+1,-z+1/2 |
8_665 |
2 |
1 |
185 |
3.9 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
58 |
|
[EDO]A:423 |
1 |
1 |
188 |
f |
[EDO]A:410 |
x,y,z |
1_555 |
1 |
1 |
185 |
0.2 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
|