## |
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 |
74 |
18 |
16355 |
x |
A |
-x+1/2,-y,z-1/2 |
2_554 |
69 |
18 |
16355 |
635.0 |
-0.9 |
0.533 |
5 |
0 |
0 |
0.000 |
2 |
|
A |
71 |
19 |
16355 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
66 |
17 |
16355 |
581.9 |
-2.5 |
0.379 |
3 |
0 |
0 |
0.000 |
3 |
|
A |
29 |
9 |
16355 |
x |
A |
-x,y-1/2,-z-1/2 |
3_544 |
34 |
11 |
16355 |
282.4 |
-2.3 |
0.215 |
3 |
3 |
0 |
0.000 |
4 |
|
A |
30 |
10 |
16355 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
27 |
9 |
16355 |
220.1 |
2.2 |
0.751 |
5 |
0 |
0 |
0.000 |
5 |
|
[TEP]A:531 |
13 |
1 |
319 |
f |
A |
x,y,z |
1_555 |
37 |
12 |
16355 |
207.6 |
4.9 |
0.299 |
0 |
0 |
0 |
0.000 |
6 |
|
A |
22 |
8 |
16355 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
24 |
9 |
16355 |
197.3 |
0.7 |
0.529 |
2 |
2 |
0 |
0.000 |
7 |
|
[NAG]A:530 |
11 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
14 |
8 |
16355 |
127.5 |
3.0 |
0.361 |
1 |
0 |
0 |
0.000 |
8 |
|
[EDO]A:524 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
21 |
12 |
16355 |
123.5 |
3.4 |
0.542 |
2 |
0 |
0 |
0.000 |
9 |
|
[EDO]A:525 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
23 |
12 |
16355 |
121.1 |
2.9 |
0.415 |
3 |
0 |
0 |
0.000 |
10 |
|
[EDO]A:513 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
16355 |
120.2 |
3.9 |
0.637 |
3 |
0 |
0 |
0.000 |
11 |
|
[DMS]A:506 |
4 |
1 |
208 |
◊ |
A |
x,y,z |
1_555 |
20 |
7 |
16355 |
115.8 |
2.7 |
0.491 |
1 |
0 |
0 |
0.000 |
12 |
|
[EDO]A:517 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
16355 |
115.4 |
4.4 |
0.701 |
6 |
0 |
0 |
0.000 |
13 |
|
[EDO]A:510 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
16355 |
112.7 |
4.0 |
0.545 |
3 |
0 |
0 |
0.000 |
14 |
|
[DMS]A:507 |
4 |
1 |
207 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
16355 |
112.1 |
2.6 |
0.307 |
0 |
0 |
0 |
0.000 |
15 |
|
[EDO]A:529 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
22 |
8 |
16355 |
112.0 |
2.6 |
0.350 |
2 |
0 |
0 |
0.000 |
16 |
|
[EDO]A:512 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
17 |
7 |
16355 |
111.7 |
3.8 |
0.533 |
3 |
0 |
0 |
0.000 |
17 |
|
[EDO]A:520 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
18 |
6 |
16355 |
111.2 |
4.1 |
0.651 |
3 |
0 |
0 |
0.000 |
18 |
|
[EDO]A:511 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
16355 |
110.7 |
3.1 |
0.451 |
2 |
0 |
0 |
0.000 |
19 |
|
[SO4]A:503 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
5 |
16355 |
109.4 |
-14.1 |
0.876 |
6 |
0 |
0 |
0.055 |
20 |
|
[EDO]A:526 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
16355 |
109.0 |
3.1 |
0.387 |
1 |
0 |
0 |
0.000 |
21 |
|
[EDO]A:522 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
19 |
8 |
16355 |
107.2 |
3.7 |
0.521 |
3 |
0 |
0 |
0.000 |
22 |
|
[EDO]A:514 |
4 |
1 |
181 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
16355 |
105.3 |
3.1 |
0.487 |
3 |
0 |
0 |
0.000 |
23 |
|
[EDO]A:518 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
16355 |
101.5 |
2.7 |
0.437 |
2 |
0 |
0 |
0.000 |
24 |
|
[SO4]A:505 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
16355 |
101.3 |
-15.3 |
0.696 |
3 |
0 |
0 |
0.055 |
25 |
|
[EDO]A:528 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
16355 |
98.4 |
3.0 |
0.468 |
3 |
0 |
0 |
0.000 |
26 |
|
[EDO]A:519 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
4 |
16355 |
96.1 |
3.3 |
0.307 |
2 |
0 |
0 |
0.000 |
27 |
|
[DMS]A:508 |
4 |
1 |
210 |
◊ |
A |
x,y,z |
1_555 |
12 |
7 |
16355 |
92.9 |
2.0 |
0.437 |
2 |
0 |
0 |
0.000 |
28 |
|
[EDO]A:527 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
16 |
6 |
16355 |
89.2 |
1.0 |
0.171 |
0 |
0 |
0 |
0.000 |
29 |
|
[SO4]A:501 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
16355 |
87.7 |
-11.5 |
0.762 |
5 |
0 |
0 |
0.045 |
30 |
|
[EDO]A:523 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
16355 |
86.5 |
2.3 |
0.435 |
2 |
0 |
0 |
0.000 |
31 |
|
[NAG]A:530 |
7 |
1 |
363 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
9 |
3 |
16355 |
86.3 |
0.5 |
0.223 |
2 |
0 |
0 |
0.000 |
32 |
|
[DMS]A:509 |
4 |
1 |
210 |
f |
A |
x,y,z |
1_555 |
14 |
4 |
16355 |
83.1 |
1.6 |
0.418 |
1 |
0 |
0 |
0.000 |
33 |
|
[SO4]A:502 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
16355 |
75.6 |
-10.6 |
0.844 |
3 |
0 |
0 |
0.039 |
34 |
|
[EDO]A:515 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
3 |
16355 |
75.6 |
2.6 |
0.302 |
1 |
0 |
0 |
0.000 |
35 |
|
A |
11 |
5 |
16355 |
◊ |
[SO4]A:501 |
-x+1/2,-y,z-1/2 |
2_554 |
4 |
1 |
184 |
67.9 |
-8.4 |
0.823 |
4 |
0 |
0 |
0.000 |
36 |
|
[EDO]A:521 |
4 |
1 |
185 |
f |
A |
x-1/2,-y-1/2,-z |
4_445 |
10 |
3 |
16355 |
66.7 |
1.5 |
0.718 |
2 |
0 |
0 |
0.000 |
37 |
|
[EDO]A:516 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
16355 |
66.2 |
3.0 |
0.964 |
1 |
0 |
0 |
0.000 |
38 |
|
[EDO]A:523 |
4 |
1 |
185 |
f |
A |
x-1/2,-y-1/2,-z |
4_445 |
8 |
4 |
16355 |
64.8 |
1.1 |
0.652 |
1 |
0 |
0 |
0.000 |
39 |
|
[DMS]A:507 |
4 |
1 |
207 |
f |
A |
-x,y-1/2,-z-1/2 |
3_544 |
9 |
3 |
16355 |
64.8 |
0.4 |
0.299 |
0 |
0 |
0 |
0.000 |
40 |
|
[SO4]A:504 |
5 |
1 |
185 |
f |
A |
x-1/2,-y+1/2,-z |
4_455 |
8 |
3 |
16355 |
64.4 |
-8.0 |
0.808 |
3 |
0 |
0 |
0.031 |
41 |
|
A |
9 |
3 |
16355 |
◊ |
[SO4]A:502 |
x-1/2,-y-1/2,-z |
4_445 |
4 |
1 |
185 |
64.4 |
-6.6 |
0.946 |
4 |
0 |
0 |
0.000 |
42 |
|
[EDO]A:521 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
10 |
6 |
16355 |
58.2 |
2.1 |
0.856 |
0 |
0 |
0 |
0.000 |
43 |
|
A |
8 |
2 |
16355 |
◊ |
[SO4]A:505 |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
1 |
185 |
46.2 |
-5.1 |
0.883 |
3 |
0 |
0 |
0.000 |
44 |
|
[SO4]A:504 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
16355 |
37.8 |
-4.4 |
0.835 |
1 |
0 |
0 |
0.000 |
45 |
|
[EDO]A:515 |
4 |
1 |
184 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
2 |
1 |
16355 |
37.1 |
1.9 |
0.980 |
1 |
0 |
0 |
0.000 |
46 |
|
[NAG]A:530 |
5 |
1 |
363 |
◊ |
[SO4]A:504 |
x,y,z |
1_555 |
3 |
1 |
185 |
36.9 |
-4.1 |
0.357 |
1 |
0 |
0 |
0.000 |
47 |
|
A |
3 |
1 |
16355 |
◊ |
[SO4]A:504 |
-x,y-1/2,-z-1/2 |
3_544 |
4 |
1 |
185 |
35.1 |
-3.1 |
0.954 |
2 |
0 |
0 |
0.000 |
48 |
|
[TEP]A:531 |
4 |
1 |
319 |
f |
[EDO]A:529 |
x,y,z |
1_555 |
3 |
1 |
187 |
34.5 |
1.9 |
0.413 |
0 |
0 |
0 |
0.000 |
49 |
|
A |
7 |
2 |
16355 |
f |
[EDO]A:518 |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
185 |
34.0 |
1.2 |
0.783 |
0 |
0 |
0 |
0.000 |
50 |
|
[DMS]A:508 |
1 |
1 |
210 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
1 |
16355 |
31.0 |
1.3 |
0.587 |
0 |
0 |
0 |
0.000 |
51 |
|
[EDO]A:522 |
3 |
1 |
184 |
f |
[EDO]A:514 |
x,y,z |
1_555 |
2 |
1 |
181 |
26.1 |
1.5 |
1.000 |
0 |
0 |
0 |
0.000 |
52 |
|
A |
2 |
1 |
16355 |
f |
[EDO]A:527 |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
1 |
184 |
23.7 |
0.2 |
0.380 |
0 |
0 |
0 |
0.000 |
53 |
|
A |
4 |
2 |
16355 |
f |
[EDO]A:510 |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
184 |
17.4 |
0.4 |
0.624 |
0 |
0 |
0 |
0.000 |
54 |
|
[EDO]A:514 |
3 |
1 |
181 |
f |
[EDO]A:512 |
x,y,z |
1_555 |
3 |
1 |
184 |
16.4 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
55 |
|
[EDO]A:522 |
2 |
1 |
184 |
f |
A |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
1 |
16355 |
14.3 |
0.0 |
0.594 |
0 |
0 |
0 |
0.000 |
56 |
|
[TEP]A:531 |
2 |
1 |
319 |
f |
[EDO]A:524 |
x,y,z |
1_555 |
1 |
1 |
186 |
8.9 |
0.2 |
0.308 |
0 |
0 |
0 |
0.000 |
57 |
|
[EDO]A:523 |
1 |
1 |
185 |
f |
[EDO]A:520 |
x,y,z |
1_555 |
2 |
1 |
184 |
7.6 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
58 |
|
[EDO]A:516 |
1 |
1 |
185 |
f |
[EDO]A:510 |
x,y,z |
1_555 |
1 |
1 |
184 |
6.3 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
59 |
|
A |
1 |
1 |
16355 |
f |
[DMS]A:508 |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
210 |
3.2 |
0.1 |
0.304 |
0 |
0 |
0 |
0.000 |
60 |
|
A |
2 |
1 |
16355 |
f |
[DMS]A:506 |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
208 |
2.7 |
0.2 |
0.424 |
0 |
0 |
0 |
0.000 |
61 |
|
[EDO]A:515 |
1 |
1 |
184 |
◊ |
[SO4]A:501 |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
184 |
0.3 |
-0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
62 |
|
[DMS]A:508 |
1 |
1 |
210 |
◊ |
[SO4]A:505 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
185 |
0.3 |
0.0 |
0.500 |
0 |
0 |
0 |
0.000 |
|