## |
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 |
143 |
41 |
21398 |
◊ |
A |
x,-y,-z |
4_555 |
143 |
41 |
21398 |
1381.2 |
-26.3 |
0.503 |
10 |
2 |
0 |
0.671 |
2 |
|
[78M]A:520 |
22 |
1 |
624 |
f |
A |
x,y,z |
1_555 |
48 |
20 |
21398 |
372.8 |
-1.2 |
0.445 |
0 |
0 |
0 |
0.051 |
3 |
|
[78M]A:513 |
22 |
1 |
628 |
f |
A |
x,y,z |
1_555 |
46 |
17 |
21398 |
349.4 |
-3.0 |
0.414 |
3 |
0 |
0 |
0.188 |
4 |
|
A |
28 |
9 |
21398 |
x |
A |
x-1/2,-y+1/2,-z |
8_455 |
31 |
10 |
21398 |
301.4 |
-7.0 |
0.206 |
0 |
0 |
0 |
0.000 |
5 |
|
[78M]A:519 |
21 |
1 |
623 |
f |
A |
x,y,z |
1_555 |
35 |
15 |
21398 |
296.1 |
-3.0 |
0.370 |
0 |
0 |
0 |
0.129 |
6 |
|
[78M]A:516 |
21 |
1 |
609 |
f |
A |
x,y,z |
1_555 |
36 |
11 |
21398 |
296.1 |
-1.1 |
0.441 |
0 |
0 |
0 |
0.047 |
7 |
|
[78M]A:512 |
22 |
1 |
613 |
f |
A |
x,y,z |
1_555 |
39 |
13 |
21398 |
295.2 |
-2.6 |
0.382 |
3 |
0 |
0 |
0.169 |
8 |
|
[78M]A:518 |
20 |
1 |
604 |
◊ |
A |
x,y,z |
1_555 |
31 |
12 |
21398 |
278.9 |
-1.1 |
0.408 |
0 |
0 |
0 |
0.000 |
9 |
|
[78M]A:521 |
21 |
1 |
614 |
f |
A |
x,y,z |
1_555 |
31 |
10 |
21398 |
271.5 |
-1.1 |
0.468 |
1 |
0 |
0 |
0.065 |
10 |
|
[78M]A:510 |
19 |
1 |
619 |
f |
A |
x,y,z |
1_555 |
40 |
13 |
21398 |
264.8 |
-1.0 |
0.574 |
0 |
0 |
0 |
0.041 |
11 |
|
[78M]A:508 |
20 |
1 |
620 |
f |
A |
x,y,z |
1_555 |
33 |
12 |
21398 |
261.1 |
-3.5 |
0.338 |
2 |
0 |
0 |
0.188 |
12 |
|
[78M]A:502 |
20 |
1 |
613 |
f |
A |
x,y,z |
1_555 |
34 |
11 |
21398 |
259.0 |
0.9 |
0.639 |
1 |
0 |
0 |
0.000 |
13 |
|
[78M]A:507 |
20 |
1 |
631 |
f |
A |
x,y,z |
1_555 |
37 |
13 |
21398 |
249.9 |
-1.0 |
0.523 |
2 |
0 |
0 |
0.081 |
14 |
|
[78M]A:506 |
18 |
1 |
599 |
f |
A |
x,y,z |
1_555 |
34 |
11 |
21398 |
246.2 |
-1.8 |
0.492 |
0 |
0 |
0 |
0.080 |
15 |
|
[78M]A:517 |
21 |
1 |
612 |
f |
A |
x,y,z |
1_555 |
30 |
11 |
21398 |
243.3 |
-0.6 |
0.460 |
1 |
0 |
0 |
0.046 |
16 |
|
[78M]A:509 |
20 |
1 |
609 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
28 |
10 |
21398 |
239.9 |
-1.3 |
0.448 |
1 |
0 |
0 |
0.000 |
17 |
|
[78M]A:504 |
20 |
1 |
615 |
f |
A |
x,y,z |
1_555 |
30 |
11 |
21398 |
238.3 |
-0.6 |
0.459 |
1 |
0 |
0 |
0.046 |
18 |
|
[78M]A:505 |
19 |
1 |
627 |
◊ |
A |
x,y,z |
1_555 |
28 |
10 |
21398 |
230.9 |
1.2 |
0.537 |
1 |
0 |
0 |
0.000 |
19 |
|
[78M]A:514 |
18 |
1 |
630 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
25 |
10 |
21398 |
218.2 |
-1.0 |
0.438 |
1 |
0 |
0 |
0.000 |
20 |
|
A |
23 |
8 |
21398 |
x |
A |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
25 |
9 |
21398 |
215.4 |
-0.8 |
0.832 |
2 |
1 |
0 |
0.000 |
21 |
|
[78M]A:515 |
17 |
1 |
606 |
◊ |
A |
x,y,z |
1_555 |
20 |
10 |
21398 |
206.7 |
1.0 |
0.470 |
1 |
0 |
0 |
0.000 |
22 |
|
[78M]A:511 |
19 |
1 |
624 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
20 |
8 |
21398 |
191.3 |
-0.8 |
0.378 |
0 |
0 |
0 |
0.000 |
23 |
|
A |
20 |
5 |
21398 |
◊ |
A |
-x+1,y,-z-1/2 |
3_654 |
20 |
5 |
21398 |
167.0 |
-1.7 |
0.706 |
0 |
0 |
0 |
0.000 |
24 |
|
[PGE]A:523 |
9 |
1 |
325 |
f |
A |
x,y,z |
1_555 |
26 |
10 |
21398 |
148.1 |
2.7 |
0.261 |
1 |
0 |
0 |
0.000 |
25 |
|
[78M]A:503 |
17 |
1 |
618 |
f |
[78M]A:505 |
x-1/2,-y+1/2,-z |
8_455 |
18 |
1 |
627 |
139.5 |
2.6 |
0.456 |
0 |
0 |
0 |
0.000 |
26 |
|
[78M]A:509 |
14 |
1 |
609 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
21398 |
138.1 |
-0.7 |
0.509 |
1 |
0 |
0 |
0.050 |
27 |
|
[78M]A:514 |
15 |
1 |
630 |
cf |
[78M]A:511 |
x,y,z |
1_555 |
14 |
1 |
624 |
134.3 |
2.7 |
0.432 |
0 |
0 |
0 |
0.000 |
28 |
|
[78M]A:511 |
14 |
1 |
624 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
21398 |
133.2 |
-0.2 |
0.421 |
1 |
0 |
0 |
0.027 |
29 |
|
[PG0]A:522 |
8 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
21398 |
127.3 |
3.5 |
0.205 |
1 |
0 |
0 |
0.000 |
30 |
|
[78M]A:503 |
12 |
1 |
618 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
12 |
5 |
21398 |
126.1 |
-1.0 |
0.267 |
0 |
0 |
0 |
0.000 |
31 |
|
[78M]A:511 |
18 |
1 |
624 |
f |
[78M]A:507 |
x,y,z |
1_555 |
15 |
1 |
631 |
123.9 |
2.2 |
0.391 |
0 |
0 |
0 |
0.000 |
32 |
|
[78M]A:504 |
11 |
1 |
615 |
◊ |
[78M]A:503 |
x,y,z |
1_555 |
16 |
1 |
618 |
121.3 |
3.2 |
0.518 |
1 |
0 |
0 |
0.000 |
33 |
|
[78M]A:520 |
18 |
1 |
624 |
f |
[78M]A:516 |
x,y,z |
1_555 |
12 |
1 |
609 |
114.7 |
2.5 |
0.432 |
0 |
0 |
0 |
0.000 |
34 |
|
[78M]A:506 |
15 |
1 |
599 |
◊ |
A |
x,-y,-z |
4_555 |
12 |
4 |
21398 |
111.9 |
-0.3 |
0.354 |
0 |
0 |
0 |
0.013 |
35 |
|
[78M]A:514 |
15 |
1 |
630 |
f |
[78M]A:507 |
x,y,z |
1_555 |
11 |
1 |
631 |
97.4 |
2.9 |
0.479 |
0 |
0 |
0 |
0.000 |
36 |
|
[78M]A:517 |
10 |
1 |
612 |
f |
[78M]A:512 |
x,y,z |
1_555 |
7 |
1 |
613 |
95.8 |
1.9 |
0.484 |
0 |
0 |
0 |
0.000 |
37 |
|
[78M]A:503 |
12 |
1 |
618 |
◊ |
A |
x,y,z |
1_555 |
14 |
3 |
21398 |
92.9 |
1.3 |
0.572 |
0 |
0 |
0 |
0.000 |
38 |
|
[78M]A:519 |
13 |
1 |
623 |
f |
[78M]A:508 |
x,y,z |
1_555 |
9 |
1 |
620 |
91.9 |
3.1 |
0.521 |
0 |
0 |
0 |
0.000 |
39 |
|
[78M]A:515 |
13 |
1 |
606 |
◊ |
[78M]A:504 |
x,y,z |
1_555 |
12 |
1 |
615 |
90.7 |
2.5 |
0.454 |
0 |
0 |
0 |
0.000 |
40 |
|
[78M]A:520 |
8 |
1 |
624 |
f |
[78M]A:513 |
x,y,z |
1_555 |
10 |
1 |
628 |
87.3 |
1.2 |
0.408 |
0 |
0 |
0 |
0.000 |
41 |
|
[PO4]A:501 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
21398 |
83.8 |
-5.2 |
0.917 |
4 |
0 |
0 |
0.301 |
42 |
|
[78M]A:518 |
10 |
1 |
604 |
◊ |
[78M]A:505 |
x,y,z |
1_555 |
8 |
1 |
627 |
75.7 |
0.4 |
0.379 |
0 |
0 |
0 |
0.000 |
43 |
|
[78M]A:517 |
9 |
1 |
612 |
f |
[78M]A:506 |
x,y,z |
1_555 |
7 |
1 |
599 |
68.6 |
0.7 |
0.416 |
0 |
0 |
0 |
0.000 |
44 |
|
A |
9 |
4 |
21398 |
◊ |
[78M]A:503 |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
8 |
1 |
618 |
65.4 |
-1.9 |
0.288 |
0 |
0 |
0 |
0.000 |
45 |
|
[78M]A:515 |
5 |
1 |
606 |
◊ |
[78M]A:509 |
x,y,z |
1_555 |
6 |
1 |
609 |
50.7 |
-0.6 |
0.321 |
0 |
0 |
0 |
0.000 |
46 |
|
[78M]A:521 |
6 |
1 |
614 |
f |
[78M]A:519 |
x,y,z |
1_555 |
6 |
1 |
623 |
46.7 |
2.1 |
0.550 |
0 |
0 |
0 |
0.000 |
47 |
|
[78M]A:516 |
8 |
1 |
609 |
f |
[78M]A:513 |
x,y,z |
1_555 |
3 |
1 |
628 |
46.6 |
-0.7 |
0.268 |
0 |
0 |
0 |
0.028 |
48 |
|
[78M]A:518 |
8 |
1 |
604 |
◊ |
[78M]A:513 |
x,y,z |
1_555 |
9 |
1 |
628 |
45.2 |
0.8 |
0.392 |
0 |
0 |
0 |
0.000 |
49 |
|
[78M]A:511 |
8 |
1 |
624 |
f |
[78M]A:504 |
x,y,z |
1_555 |
4 |
1 |
615 |
43.0 |
0.1 |
0.347 |
0 |
0 |
0 |
0.000 |
50 |
|
[78M]A:509 |
4 |
1 |
609 |
f |
[78M]A:518 |
x-1/2,-y+1/2,-z |
8_455 |
4 |
1 |
604 |
41.4 |
-1.3 |
0.248 |
0 |
0 |
0 |
0.057 |
51 |
|
[PGE]A:523 |
3 |
1 |
325 |
f |
[PG0]A:522 |
x,y,z |
1_555 |
3 |
1 |
292 |
35.1 |
2.0 |
0.128 |
0 |
0 |
0 |
0.000 |
52 |
|
[78M]A:510 |
5 |
1 |
619 |
f |
[78M]A:507 |
x,y,z |
1_555 |
3 |
1 |
631 |
32.0 |
0.3 |
0.378 |
0 |
0 |
0 |
0.000 |
53 |
|
[78M]A:505 |
3 |
1 |
627 |
f |
[78M]A:505 |
-x+1,y,-z-1/2 |
3_654 |
3 |
1 |
627 |
32.0 |
-3.2 |
0.123 |
1 |
0 |
0 |
0.145 |
54 |
|
[78M]A:505 |
4 |
1 |
627 |
f |
[78M]A:503 |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
3 |
1 |
618 |
30.2 |
-1.7 |
0.221 |
1 |
0 |
0 |
0.167 |
55 |
|
[78M]A:511 |
4 |
1 |
624 |
◊ |
[78M]A:503 |
x,y,z |
1_555 |
5 |
1 |
618 |
30.1 |
0.5 |
0.415 |
0 |
0 |
0 |
0.000 |
56 |
|
[PG0]A:522 |
3 |
1 |
292 |
◊ |
A |
x,-y,-z |
4_555 |
2 |
1 |
21398 |
29.2 |
2.0 |
0.196 |
0 |
0 |
0 |
0.000 |
57 |
|
[78M]A:505 |
4 |
1 |
627 |
◊ |
A |
-x+1,y,-z-1/2 |
3_654 |
3 |
1 |
21398 |
27.6 |
-1.0 |
0.265 |
0 |
0 |
0 |
0.000 |
58 |
|
[PG0]A:522 |
3 |
1 |
292 |
f |
[78M]A:506 |
x,y,z |
1_555 |
2 |
1 |
599 |
25.3 |
0.4 |
0.148 |
0 |
0 |
0 |
0.000 |
59 |
|
[78M]A:515 |
4 |
1 |
606 |
◊ |
[78M]A:518 |
x-1/2,-y+1/2,-z |
8_455 |
1 |
1 |
604 |
18.9 |
-0.1 |
0.408 |
0 |
0 |
0 |
0.000 |
60 |
|
[78M]A:521 |
2 |
1 |
614 |
f |
[78M]A:502 |
x,y,z |
1_555 |
4 |
1 |
613 |
15.4 |
0.1 |
0.352 |
0 |
0 |
0 |
0.000 |
61 |
|
[78M]A:507 |
3 |
1 |
631 |
f |
[78M]A:504 |
x,y,z |
1_555 |
3 |
1 |
615 |
13.6 |
-0.2 |
0.367 |
0 |
0 |
0 |
0.007 |
62 |
|
A |
3 |
2 |
21398 |
◊ |
[78M]A:504 |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
4 |
1 |
615 |
8.1 |
-0.3 |
0.460 |
0 |
0 |
0 |
0.000 |
63 |
|
[78M]A:509 |
1 |
1 |
609 |
◊ |
[PO4]A:501 |
x-1/2,-y+1/2,-z |
8_455 |
1 |
1 |
188 |
7.3 |
-0.5 |
0.572 |
0 |
0 |
0 |
0.000 |
64 |
|
[78M]A:504 |
3 |
1 |
615 |
◊ |
[78M]A:505 |
x-1/2,-y+1/2,-z |
8_455 |
1 |
1 |
627 |
6.9 |
0.1 |
0.431 |
0 |
0 |
0 |
0.000 |
65 |
|
[78M]A:506 |
2 |
1 |
599 |
◊ |
[78M]A:506 |
x,-y,-z |
4_555 |
2 |
1 |
599 |
6.7 |
-0.1 |
0.357 |
0 |
0 |
0 |
0.003 |
66 |
|
[78M]A:504 |
1 |
1 |
615 |
◊ |
A |
x-1/2,-y+1/2,-z |
8_455 |
1 |
1 |
21398 |
6.2 |
-0.2 |
0.385 |
0 |
0 |
0 |
0.000 |
67 |
|
[78M]A:516 |
2 |
1 |
609 |
◊ |
[78M]A:505 |
x,y,z |
1_555 |
1 |
1 |
627 |
6.0 |
-0.2 |
0.387 |
0 |
0 |
0 |
0.000 |
68 |
|
[78M]A:510 |
1 |
1 |
619 |
◊ |
A |
x,-y,-z |
4_555 |
1 |
1 |
21398 |
4.7 |
-0.0 |
0.435 |
0 |
0 |
0 |
0.000 |
69 |
|
[78M]A:515 |
1 |
1 |
606 |
f |
[78M]A:505 |
x-1/2,-y+1/2,-z |
8_455 |
1 |
1 |
627 |
3.6 |
0.1 |
0.431 |
0 |
0 |
0 |
0.000 |
70 |
|
A |
1 |
1 |
21398 |
◊ |
[78M]A:516 |
x-1/2,-y+1/2,-z |
8_455 |
1 |
1 |
609 |
1.5 |
-0.1 |
0.478 |
0 |
0 |
0 |
0.000 |
|