| ## |
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 |
98 |
25 |
11926 |
◊ |
B |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
90 |
26 |
11952 |
875.8 |
-15.9 |
0.036 |
15 |
0 |
0 |
0.238 |
| 2 |
2 |
|
[NAD]B:901 |
40 |
1 |
861 |
f |
B |
x,y,z |
1_555 |
74 |
28 |
11952 |
544.2 |
-5.2 |
0.502 |
11 |
0 |
0 |
0.210 |
3 |
|
[NAD]A:901 |
40 |
1 |
864 |
f |
A |
x,y,z |
1_555 |
76 |
28 |
11926 |
543.8 |
-5.4 |
0.508 |
10 |
0 |
0 |
0.210 |
| Average: |
544.0 |
-5.3 |
0.505 |
11 |
0 |
0 |
0.210 |
| 3 |
4 |
|
B |
68 |
19 |
11952 |
◊ |
A |
x,y,z |
1_555 |
53 |
17 |
11926 |
537.7 |
-5.0 |
0.351 |
1 |
2 |
0 |
0.000 |
| 4 |
5 |
|
A |
49 |
16 |
11926 |
◊ |
A |
x,-y,-z |
3_555 |
49 |
16 |
11926 |
497.9 |
1.1 |
0.851 |
8 |
8 |
0 |
0.000 |
| 5 |
6 |
|
B |
37 |
15 |
11952 |
◊ |
B |
-x-1,y,-z+3/2 |
4_456 |
37 |
15 |
11952 |
356.4 |
-2.7 |
0.431 |
2 |
0 |
0 |
0.000 |
7 |
|
A |
27 |
10 |
11926 |
◊ |
A |
-x,y,-z+1/2 |
4_555 |
27 |
10 |
11926 |
225.1 |
-3.1 |
0.326 |
3 |
0 |
0 |
0.000 |
| Average: |
290.8 |
-2.9 |
0.379 |
3 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[2YJ]B:904 |
17 |
1 |
499 |
f |
B |
x,y,z |
1_555 |
44 |
17 |
11952 |
283.3 |
5.3 |
0.153 |
6 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[2YJ]A:904 |
17 |
1 |
502 |
f |
A |
x,y,z |
1_555 |
37 |
16 |
11926 |
274.0 |
5.4 |
0.122 |
6 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[EDO]A:905 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
11926 |
115.0 |
3.8 |
0.516 |
3 |
0 |
0 |
0.000 |
| 9 |
11 |
|
[GOL]B:905 |
6 |
1 |
219 |
◊ |
B |
x,y,z |
1_555 |
17 |
7 |
11952 |
92.6 |
-1.4 |
0.361 |
1 |
0 |
0 |
0.019 |
| 10 |
12 |
|
A |
18 |
7 |
11926 |
f |
[GOL]B:905 |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
6 |
1 |
219 |
89.1 |
-1.4 |
0.367 |
1 |
0 |
0 |
0.019 |
| 11 |
13 |
|
[EDO]A:906 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
11926 |
71.2 |
0.9 |
0.432 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
[NA]A:902 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
11926 |
62.9 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.264 |
15 |
|
[NA]B:902 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
11952 |
62.1 |
-12.4 |
0.000 |
0 |
0 |
0 |
0.264 |
| Average: |
62.5 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.264 |
| 13 |
16 |
|
B |
7 |
3 |
11952 |
x |
B |
x-1/2,-y-1/2,-z+1 |
7_446 |
7 |
2 |
11952 |
60.4 |
0.5 |
0.743 |
1 |
1 |
0 |
0.000 |
| 14 |
17 |
|
[2YJ]A:904 |
4 |
1 |
502 |
f |
[NAD]A:901 |
x,y,z |
1_555 |
11 |
1 |
864 |
60.0 |
0.1 |
0.310 |
1 |
0 |
0 |
0.003 |
| 15 |
18 |
|
[2YJ]B:904 |
5 |
1 |
499 |
f |
[NAD]B:901 |
x,y,z |
1_555 |
9 |
1 |
861 |
56.4 |
0.3 |
0.242 |
1 |
0 |
0 |
0.001 |
| 16 |
19 |
|
[SO4]A:907 |
4 |
1 |
185 |
f |
[2YJ]A:904 |
x,y,z |
1_555 |
6 |
1 |
502 |
51.4 |
-5.3 |
0.069 |
1 |
0 |
0 |
0.060 |
| 17 |
20 |
|
[NAD]B:901 |
7 |
1 |
861 |
◊ |
B |
-x-1,y,-z+3/2 |
4_456 |
11 |
4 |
11952 |
50.9 |
0.7 |
0.683 |
0 |
0 |
0 |
0.000 |
21 |
|
[NAD]A:901 |
6 |
1 |
864 |
◊ |
A |
-x,y,-z+1/2 |
4_555 |
10 |
4 |
11926 |
50.0 |
0.7 |
0.709 |
0 |
0 |
0 |
0.000 |
| Average: |
50.4 |
0.7 |
0.696 |
0 |
0 |
0 |
0.000 |
| 18 |
22 |
|
[SO4]A:907 |
5 |
1 |
185 |
f |
[NAD]A:901 |
x,y,z |
1_555 |
7 |
1 |
864 |
46.1 |
-6.5 |
0.686 |
0 |
0 |
0 |
0.069 |
| 19 |
23 |
|
[EDO]B:906 |
4 |
1 |
184 |
f |
[2YJ]B:904 |
x,y,z |
1_555 |
6 |
1 |
499 |
45.2 |
2.5 |
0.064 |
0 |
0 |
0 |
0.000 |
| 20 |
24 |
|
[EDO]B:906 |
3 |
1 |
184 |
f |
[NAD]B:901 |
x,y,z |
1_555 |
8 |
1 |
861 |
42.4 |
-0.1 |
0.658 |
0 |
0 |
0 |
0.001 |
| 21 |
25 |
|
[MG]B:903 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
11952 |
41.9 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.154 |
26 |
|
[MG]A:903 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
11926 |
41.9 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.154 |
| Average: |
41.9 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.154 |
| 22 |
27 |
|
[SO4]A:907 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
5 |
4 |
11926 |
33.3 |
-3.5 |
0.870 |
0 |
0 |
0 |
0.037 |
| 23 |
28 |
|
B |
4 |
2 |
11952 |
◊ |
A |
-x-1,y,-z+1/2 |
4_455 |
5 |
3 |
11926 |
27.6 |
0.6 |
0.619 |
0 |
0 |
0 |
0.000 |
| 24 |
29 |
|
[MG]A:903 |
1 |
1 |
98 |
f |
[NAD]A:901 |
x,y,z |
1_555 |
3 |
1 |
864 |
25.9 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.050 |
30 |
|
[MG]B:903 |
1 |
1 |
98 |
f |
[NAD]B:901 |
x,y,z |
1_555 |
3 |
1 |
861 |
25.9 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.050 |
| Average: |
25.9 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.050 |
| 25 |
31 |
|
[EDO]A:906 |
2 |
1 |
184 |
f |
[2YJ]A:904 |
x,y,z |
1_555 |
2 |
1 |
502 |
21.5 |
0.8 |
0.319 |
0 |
0 |
0 |
0.000 |
| 26 |
32 |
|
[EDO]B:906 |
3 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
3 |
3 |
11952 |
19.5 |
0.5 |
0.801 |
0 |
0 |
0 |
0.000 |
| 27 |
33 |
|
[NA]B:902 |
1 |
1 |
125 |
f |
[NAD]B:901 |
x,y,z |
1_555 |
2 |
1 |
861 |
3.1 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.005 |
34 |
|
[NA]A:902 |
1 |
1 |
125 |
f |
[NAD]A:901 |
x,y,z |
1_555 |
2 |
1 |
864 |
1.4 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.005 |
| Average: |
2.3 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.005 |
| 28 |
35 |
|
B |
1 |
1 |
11952 |
◊ |
A |
x-1/2,-y-1/2,-z+1 |
7_446 |
1 |
1 |
11926 |
2.3 |
-0.1 |
0.443 |
0 |
0 |
0 |
0.000 |
|