| ## |
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 |
47 |
18 |
12321 |
x |
A |
x,y,z-1 |
1_554 |
54 |
23 |
12321 |
530.2 |
-4.2 |
0.297 |
5 |
0 |
0 |
0.000 |
2 |
|
A |
38 |
13 |
12321 |
x |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
39 |
10 |
12321 |
315.7 |
0.5 |
0.607 |
6 |
1 |
0 |
0.000 |
3 |
|
A |
28 |
9 |
12321 |
◊ |
A |
-x+1,-y,z |
2_655 |
28 |
9 |
12321 |
271.5 |
-2.2 |
0.391 |
4 |
0 |
0 |
0.000 |
4 |
|
A |
18 |
5 |
12321 |
◊ |
A |
-x+2,-y,z |
2_755 |
18 |
5 |
12321 |
172.1 |
-0.8 |
0.508 |
4 |
4 |
0 |
0.000 |
5 |
|
[GOL]A:366 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
12321 |
133.9 |
0.1 |
0.639 |
3 |
0 |
0 |
0.000 |
6 |
|
A |
11 |
4 |
12321 |
x |
A |
x-1,y,z |
1_455 |
10 |
4 |
12321 |
103.9 |
0.3 |
0.507 |
0 |
0 |
0 |
0.000 |
7 |
|
[GOL]A:364 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
20 |
7 |
12321 |
101.6 |
-0.4 |
0.523 |
2 |
0 |
0 |
0.000 |
8 |
|
[EOH]A:358 |
3 |
1 |
173 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
12321 |
94.8 |
3.6 |
0.314 |
2 |
0 |
0 |
0.000 |
9 |
|
[EOH]A:346 |
3 |
1 |
172 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
12321 |
88.5 |
3.1 |
0.307 |
2 |
0 |
0 |
0.000 |
10 |
|
[EOH]A:345 |
3 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
12321 |
88.0 |
3.8 |
0.352 |
2 |
0 |
0 |
0.000 |
11 |
|
[ACT]A:361 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
12321 |
87.5 |
1.3 |
0.830 |
0 |
0 |
0 |
0.000 |
12 |
|
[ACT]A:363 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
12321 |
87.3 |
-0.3 |
0.650 |
0 |
0 |
0 |
0.000 |
13 |
|
[EOH]A:344 |
3 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
11 |
6 |
12321 |
80.7 |
3.3 |
0.167 |
0 |
0 |
0 |
0.000 |
14 |
|
[EOH]A:349 |
3 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
11 |
6 |
12321 |
79.4 |
3.4 |
0.332 |
0 |
0 |
0 |
0.000 |
15 |
|
[EOH]A:348 |
3 |
1 |
173 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
12321 |
79.1 |
3.0 |
0.155 |
1 |
0 |
0 |
0.000 |
16 |
|
[EOH]A:352 |
3 |
1 |
172 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
12321 |
78.5 |
2.2 |
0.139 |
1 |
0 |
0 |
0.000 |
17 |
|
[GOL]A:365 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
12321 |
76.5 |
-0.6 |
0.471 |
2 |
0 |
0 |
0.000 |
18 |
|
[EOH]A:342 |
3 |
1 |
172 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
12321 |
74.2 |
1.8 |
0.120 |
0 |
0 |
0 |
0.000 |
19 |
|
[ACE]A:370 |
3 |
1 |
171 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
12321 |
70.9 |
-0.9 |
0.632 |
0 |
0 |
0 |
0.000 |
20 |
|
[EOH]A:343 |
3 |
1 |
172 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
12321 |
69.8 |
1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
21 |
|
[EOH]A:356 |
3 |
1 |
172 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
12321 |
69.4 |
1.6 |
0.000 |
1 |
0 |
0 |
0.000 |
22 |
|
[CL]A:340 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
12321 |
69.4 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.000 |
23 |
|
[ACE]A:368 |
3 |
1 |
171 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
12321 |
68.5 |
-1.2 |
0.633 |
0 |
0 |
0 |
0.000 |
24 |
|
[ACE]A:371 |
3 |
1 |
171 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
12321 |
67.8 |
0.1 |
0.801 |
0 |
0 |
0 |
0.000 |
25 |
|
[EOH]A:359 |
3 |
1 |
172 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
12321 |
67.7 |
1.8 |
0.116 |
0 |
0 |
0 |
0.000 |
26 |
|
[ACE]A:369 |
3 |
1 |
171 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
12321 |
66.9 |
-1.0 |
0.624 |
0 |
0 |
0 |
0.000 |
27 |
|
[EOH]A:351 |
3 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
12321 |
65.7 |
2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
28 |
|
[EOH]A:353 |
3 |
1 |
173 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
12321 |
65.6 |
2.3 |
0.273 |
0 |
0 |
0 |
0.000 |
29 |
|
[EOH]A:350 |
3 |
1 |
172 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
12321 |
64.7 |
2.7 |
0.177 |
0 |
0 |
0 |
0.000 |
30 |
|
[EOH]A:347 |
3 |
1 |
173 |
f |
A |
x,y,z |
1_555 |
18 |
5 |
12321 |
63.9 |
1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
31 |
|
A |
10 |
3 |
12321 |
◊ |
[EOH]A:357 |
x,y,z-1 |
1_554 |
3 |
1 |
171 |
63.1 |
1.8 |
0.124 |
0 |
0 |
0 |
0.000 |
32 |
|
[EOH]A:357 |
3 |
1 |
171 |
f |
A |
x,y,z |
1_555 |
10 |
2 |
12321 |
61.4 |
1.9 |
0.000 |
1 |
0 |
0 |
0.000 |
33 |
|
[EOH]A:355 |
3 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
10 |
6 |
12321 |
60.8 |
1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
34 |
|
[EOH]A:354 |
3 |
1 |
171 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
12321 |
58.7 |
1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
35 |
|
[ACE]A:371 |
3 |
1 |
171 |
f |
A |
x,y,z-1 |
1_554 |
8 |
3 |
12321 |
55.4 |
-0.9 |
0.619 |
0 |
0 |
0 |
0.000 |
36 |
|
A |
11 |
4 |
12321 |
◊ |
[EOH]A:343 |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
1 |
172 |
54.0 |
1.0 |
0.661 |
0 |
0 |
0 |
0.000 |
37 |
|
A |
10 |
4 |
12321 |
◊ |
[EOH]A:350 |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
1 |
172 |
53.8 |
1.7 |
0.000 |
1 |
0 |
0 |
0.000 |
38 |
|
[EOH]A:360 |
3 |
1 |
171 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
12321 |
52.7 |
1.2 |
0.000 |
0 |
0 |
0 |
0.000 |
39 |
|
[ACT]A:362 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
12321 |
47.1 |
-0.2 |
0.669 |
0 |
0 |
0 |
0.000 |
40 |
|
[ACE]A:367 |
2 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
5 |
4 |
12321 |
42.7 |
-0.2 |
0.585 |
0 |
0 |
0 |
0.000 |
41 |
|
[GOL]A:364 |
3 |
1 |
217 |
◊ |
A |
-x+2,-y,z |
2_755 |
6 |
3 |
12321 |
41.3 |
-0.2 |
0.479 |
1 |
0 |
0 |
0.000 |
42 |
|
[ACE]A:369 |
2 |
1 |
171 |
◊ |
A |
-x+2,-y,z |
2_755 |
3 |
1 |
12321 |
40.8 |
-0.9 |
0.314 |
0 |
0 |
0 |
0.000 |
43 |
|
A |
7 |
4 |
12321 |
f |
[EOH]A:344 |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
172 |
39.1 |
1.3 |
0.246 |
0 |
0 |
0 |
0.000 |
44 |
|
[EOH]A:341 |
2 |
1 |
172 |
f |
A |
x,y,z |
1_555 |
6 |
1 |
12321 |
36.7 |
0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
45 |
|
[EOH]A:341 |
3 |
1 |
172 |
◊ |
A |
-x+2,-y,z |
2_755 |
1 |
1 |
12321 |
34.9 |
0.2 |
0.164 |
0 |
0 |
0 |
0.000 |
46 |
|
A |
4 |
2 |
12321 |
f |
[ACE]A:367 |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
1 |
172 |
34.5 |
-0.8 |
0.524 |
0 |
0 |
0 |
0.000 |
47 |
|
[ACE]A:370 |
3 |
1 |
171 |
f |
[ACE]A:368 |
x,y,z |
1_555 |
3 |
1 |
171 |
30.3 |
-0.2 |
0.906 |
0 |
0 |
0 |
0.000 |
48 |
|
[ACE]A:367 |
3 |
1 |
172 |
◊ |
[EOH]A:353 |
x,y,z |
1_555 |
2 |
1 |
173 |
30.0 |
0.1 |
0.923 |
0 |
0 |
0 |
0.000 |
49 |
|
[ACE]A:370 |
1 |
1 |
171 |
f |
[EOH]A:353 |
x,y,z |
1_555 |
3 |
1 |
173 |
29.3 |
0.2 |
0.816 |
0 |
0 |
0 |
0.000 |
50 |
|
[ACT]A:362 |
3 |
1 |
183 |
f |
[EOH]A:348 |
x,y,z |
1_555 |
3 |
1 |
173 |
27.3 |
0.6 |
0.829 |
0 |
0 |
0 |
0.000 |
51 |
|
[EOH]A:355 |
1 |
1 |
172 |
f |
[EOH]A:349 |
x,y,z |
1_555 |
2 |
1 |
172 |
26.9 |
1.2 |
0.577 |
0 |
0 |
0 |
0.000 |
52 |
|
[ACE]A:368 |
3 |
1 |
171 |
◊ |
[ACE]A:367 |
x,y,z |
1_555 |
3 |
1 |
172 |
26.8 |
-0.2 |
0.906 |
0 |
0 |
0 |
0.000 |
53 |
|
[GOL]A:364 |
4 |
1 |
217 |
f |
[EOH]A:341 |
x,y,z |
1_555 |
2 |
1 |
172 |
26.5 |
0.4 |
0.750 |
1 |
0 |
0 |
0.000 |
54 |
|
[ACE]A:371 |
3 |
1 |
171 |
f |
[EOH]A:359 |
x,y,z-1 |
1_554 |
2 |
1 |
172 |
22.9 |
0.2 |
0.923 |
0 |
0 |
0 |
0.000 |
55 |
|
[ACE]A:368 |
3 |
1 |
171 |
f |
[EOH]A:353 |
x,y,z |
1_555 |
3 |
1 |
173 |
21.7 |
0.5 |
0.981 |
1 |
0 |
0 |
0.000 |
56 |
|
A |
4 |
2 |
12321 |
◊ |
[GOL]A:365 |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
219 |
21.3 |
-0.2 |
0.578 |
0 |
0 |
0 |
0.000 |
57 |
|
A |
3 |
1 |
12321 |
◊ |
[EOH]A:350 |
x-1,y,z |
1_455 |
2 |
1 |
172 |
16.8 |
0.8 |
0.898 |
0 |
0 |
0 |
0.000 |
58 |
|
[ACE]A:367 |
1 |
1 |
172 |
◊ |
[EOH]A:350 |
x,y,z |
1_555 |
3 |
1 |
172 |
16.6 |
-0.0 |
0.816 |
0 |
0 |
0 |
0.000 |
59 |
|
[GOL]A:366 |
2 |
1 |
218 |
f |
[EOH]A:343 |
x,y,z |
1_555 |
1 |
1 |
172 |
15.4 |
0.3 |
0.441 |
0 |
0 |
0 |
0.000 |
60 |
|
[ACE]A:369 |
1 |
1 |
171 |
f |
[GOL]A:364 |
x,y,z |
1_555 |
3 |
1 |
217 |
14.0 |
-0.0 |
0.553 |
0 |
0 |
0 |
0.000 |
61 |
|
[GOL]A:366 |
1 |
1 |
218 |
◊ |
[EOH]A:355 |
x,y,z |
1_555 |
2 |
1 |
172 |
11.3 |
0.5 |
0.707 |
0 |
0 |
0 |
0.000 |
62 |
|
[ACE]A:371 |
1 |
1 |
171 |
f |
[EOH]A:345 |
x,y,z |
1_555 |
1 |
1 |
172 |
10.5 |
0.2 |
0.816 |
0 |
0 |
0 |
0.000 |
63 |
|
[EOH]A:351 |
2 |
1 |
172 |
f |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
4 |
1 |
12321 |
7.7 |
0.2 |
0.785 |
0 |
0 |
0 |
0.000 |
64 |
|
[GOL]A:366 |
1 |
1 |
218 |
f |
[EOH]A:354 |
x,y,z |
1_555 |
2 |
1 |
171 |
7.0 |
0.2 |
0.707 |
0 |
0 |
0 |
0.000 |
65 |
|
A |
1 |
1 |
12321 |
◊ |
[ACE]A:370 |
x-1,y,z |
1_455 |
1 |
1 |
171 |
6.1 |
-0.2 |
0.433 |
0 |
0 |
0 |
0.000 |
66 |
|
[EOH]A:353 |
1 |
1 |
173 |
f |
[EOH]A:350 |
x,y,z |
1_555 |
2 |
1 |
172 |
5.9 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
67 |
|
A |
1 |
1 |
12321 |
f |
[EOH]A:355 |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
172 |
3.9 |
-0.0 |
0.586 |
0 |
0 |
0 |
0.000 |
68 |
|
A |
2 |
2 |
12321 |
◊ |
[EOH]A:353 |
x-1,y,z |
1_455 |
2 |
1 |
173 |
3.6 |
0.1 |
0.767 |
0 |
0 |
0 |
0.000 |
69 |
|
A |
1 |
1 |
12321 |
◊ |
[ACE]A:367 |
x-1,y,z |
1_455 |
1 |
1 |
172 |
3.2 |
-0.0 |
0.715 |
0 |
0 |
0 |
0.000 |
70 |
|
A |
1 |
1 |
12321 |
◊ |
[EOH]A:353 |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
173 |
1.2 |
0.0 |
0.673 |
0 |
0 |
0 |
0.000 |
|