## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
A |
106 |
28 |
16340 |
x |
A |
x-1,y,z |
1_455 |
96 |
34 |
16340 |
930.0 |
-1.5 |
0.519 |
12 |
8 |
0 |
0.000 |
2 |
|
B |
102 |
28 |
16329 |
x |
B |
x-1,y,z |
1_455 |
104 |
35 |
16329 |
920.3 |
-5.5 |
0.293 |
12 |
6 |
0 |
0.000 |
Average: |
925.2 |
-3.5 |
0.406 |
12 |
7 |
0 |
0.000 |
2 |
3 |
|
B |
76 |
21 |
16329 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
72 |
19 |
16329 |
680.8 |
-7.8 |
0.141 |
6 |
0 |
0 |
0.000 |
4 |
|
A |
69 |
17 |
16340 |
x |
A |
-x,y-1/2,-z |
2_545 |
72 |
20 |
16340 |
659.2 |
-6.8 |
0.186 |
6 |
0 |
0 |
0.000 |
Average: |
670.0 |
-7.3 |
0.163 |
6 |
0 |
0 |
0.000 |
3 |
5 |
|
B |
63 |
20 |
16329 |
◊ |
A |
x,y,z |
1_555 |
61 |
20 |
16340 |
509.3 |
-0.3 |
0.630 |
6 |
0 |
0 |
0.015 |
4 |
6 |
|
[GOL]B:415 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
21 |
7 |
16329 |
113.7 |
-0.2 |
0.568 |
3 |
0 |
0 |
0.008 |
5 |
7 |
|
[SO4]B:411 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
16329 |
109.1 |
-16.1 |
0.803 |
4 |
0 |
0 |
0.089 |
6 |
8 |
|
[SO4]A:412 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
16340 |
83.3 |
-11.3 |
0.682 |
2 |
0 |
0 |
0.061 |
7 |
9 |
|
[GOL]B:413 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
16329 |
80.9 |
-0.3 |
0.489 |
1 |
0 |
0 |
0.003 |
8 |
10 |
|
[SO4]A:412 |
5 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
16329 |
80.0 |
-10.7 |
0.680 |
2 |
0 |
0 |
0.058 |
9 |
11 |
|
[SO4]A:413 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
16340 |
77.0 |
-10.1 |
0.841 |
3 |
0 |
0 |
0.057 |
10 |
12 |
|
[SO4]B:410 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
16329 |
75.3 |
-10.1 |
0.832 |
3 |
0 |
0 |
0.057 |
11 |
13 |
|
[GOL]B:414 |
5 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
16329 |
74.2 |
-0.1 |
0.572 |
2 |
0 |
0 |
0.005 |
12 |
14 |
|
[SO4]A:411 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
16340 |
72.7 |
-9.0 |
0.895 |
4 |
0 |
0 |
0.054 |
13 |
15 |
|
[SO4]B:409 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
16329 |
69.8 |
-9.1 |
0.897 |
4 |
0 |
0 |
0.054 |
14 |
16 |
|
[SO4]A:414 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
16340 |
67.7 |
-8.9 |
0.704 |
2 |
0 |
0 |
0.049 |
15 |
17 |
|
[GOL]A:416 |
4 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
16340 |
64.4 |
-0.0 |
0.556 |
1 |
0 |
0 |
0.002 |
16 |
18 |
|
[SO4]A:405 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
16340 |
61.9 |
-7.1 |
0.847 |
1 |
0 |
0 |
0.038 |
17 |
19 |
|
[SO4]B:407 |
4 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
10 |
3 |
16329 |
58.3 |
-6.7 |
0.912 |
2 |
0 |
0 |
0.038 |
18 |
20 |
|
[SO4]B:408 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
16329 |
58.3 |
-6.6 |
0.879 |
2 |
0 |
0 |
0.037 |
19 |
21 |
|
[SO4]A:408 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
16340 |
57.8 |
-6.5 |
0.925 |
2 |
0 |
0 |
0.037 |
20 |
22 |
|
[SO4]B:412 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
16329 |
57.5 |
-7.7 |
0.552 |
1 |
0 |
0 |
0.041 |
21 |
23 |
|
[SO4]A:409 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
16340 |
56.2 |
-7.6 |
0.558 |
2 |
0 |
0 |
0.042 |
22 |
24 |
|
[SO4]B:405 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
16329 |
55.5 |
-6.8 |
0.876 |
1 |
0 |
0 |
0.036 |
23 |
25 |
|
[SO4]A:406 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
16340 |
55.1 |
-7.2 |
0.861 |
1 |
0 |
0 |
0.038 |
24 |
26 |
|
[SO4]A:406 |
4 |
1 |
185 |
◊ |
A |
x-1,y,z |
1_455 |
7 |
4 |
16340 |
54.2 |
-6.9 |
0.716 |
0 |
0 |
0 |
0.000 |
25 |
27 |
|
[SO4]A:415 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
16340 |
51.2 |
-5.6 |
0.930 |
2 |
0 |
0 |
0.032 |
26 |
28 |
|
[SO4]B:405 |
5 |
1 |
185 |
◊ |
B |
x-1,y,z |
1_455 |
6 |
3 |
16329 |
50.3 |
-6.2 |
0.895 |
1 |
0 |
0 |
0.000 |
27 |
29 |
|
[SO4]A:410 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
2 |
16340 |
44.6 |
-5.7 |
0.716 |
1 |
0 |
0 |
0.031 |
28 |
30 |
|
[SO4]A:407 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
16340 |
44.0 |
-3.7 |
0.985 |
2 |
0 |
0 |
0.023 |
29 |
31 |
|
[SO4]B:406 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
2 |
1 |
16329 |
44.0 |
-3.9 |
0.984 |
2 |
0 |
0 |
0.024 |
30 |
32 |
|
[SO4]A:408 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
3 |
3 |
16329 |
37.7 |
-4.8 |
0.354 |
0 |
0 |
0 |
0.024 |
31 |
33 |
|
A |
3 |
1 |
16340 |
◊ |
[SO4]A:410 |
-x+1,y-1/2,-z |
2_645 |
4 |
1 |
184 |
36.5 |
-4.5 |
0.335 |
0 |
0 |
0 |
0.000 |
32 |
34 |
|
A |
4 |
2 |
16340 |
◊ |
[SO4]A:415 |
-x,y-1/2,-z |
2_545 |
3 |
1 |
186 |
35.6 |
-3.4 |
0.946 |
1 |
0 |
0 |
0.000 |
33 |
35 |
|
[SO4]B:407 |
3 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
16340 |
34.7 |
-4.5 |
0.422 |
0 |
0 |
0 |
0.022 |
34 |
36 |
|
[SO4]B:408 |
4 |
1 |
186 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
3 |
1 |
16329 |
32.6 |
-3.2 |
0.959 |
1 |
0 |
0 |
0.000 |
35 |
37 |
|
A |
3 |
2 |
16340 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
3 |
2 |
16340 |
22.5 |
0.2 |
0.540 |
0 |
0 |
0 |
0.000 |
38 |
|
B |
4 |
2 |
16329 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
16329 |
17.9 |
-0.2 |
0.368 |
0 |
0 |
0 |
0.000 |
Average: |
20.2 |
-0.0 |
0.454 |
0 |
0 |
0 |
0.000 |
36 |
39 |
|
[SO4]A:407 |
2 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
16329 |
20.9 |
-2.6 |
0.731 |
0 |
0 |
0 |
0.013 |
37 |
40 |
|
[SO4]B:406 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
16340 |
20.6 |
-2.5 |
0.727 |
0 |
0 |
0 |
0.012 |
38 |
41 |
|
[SO4]A:413 |
2 |
1 |
185 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
16340 |
4.7 |
-0.5 |
0.803 |
0 |
0 |
0 |
0.000 |
39 |
42 |
|
[SO4]B:410 |
1 |
1 |
186 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
16329 |
0.3 |
-0.0 |
0.806 |
0 |
0 |
0 |
0.000 |
|