| ## |
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 |
|
e |
226 |
58 |
16588 |
◊ |
1 |
x,y,z |
1_555 |
219 |
60 |
16850 |
2016.9 |
-14.0 |
0.262 |
18 |
8 |
0 |
0.112 |
| 2 |
2 |
|
N |
190 |
45 |
17696 |
◊ |
A |
x,y,z |
1_555 |
203 |
56 |
17303 |
1757.0 |
-11.5 |
0.272 |
16 |
6 |
0 |
0.116 |
| 3 |
3 |
|
A |
72 |
20 |
17303 |
◊ |
e |
x,y-1,z |
1_545 |
74 |
17 |
16588 |
615.7 |
-2.8 |
0.457 |
6 |
1 |
0 |
0.000 |
| 4 |
4 |
|
1 |
62 |
19 |
16850 |
x |
1 |
x-1/2,-y+2,-z+1/2 |
4_475 |
59 |
17 |
16850 |
502.3 |
-0.9 |
0.640 |
4 |
1 |
0 |
0.000 |
| 5 |
5 |
|
A |
56 |
16 |
17303 |
◊ |
N |
-x+1/2,-y+1,z-1/2 |
3_564 |
55 |
16 |
17696 |
469.6 |
-2.3 |
0.445 |
6 |
2 |
0 |
0.000 |
| 6 |
6 |
|
e |
48 |
15 |
16588 |
◊ |
1 |
-x,y,-z |
2_555 |
43 |
11 |
16850 |
369.8 |
0.2 |
0.664 |
3 |
2 |
0 |
0.000 |
| 7 |
7 |
|
1 |
32 |
9 |
16850 |
◊ |
e |
x-1/2,-y+2,-z+1/2 |
4_475 |
24 |
7 |
16588 |
275.6 |
-0.7 |
0.413 |
3 |
0 |
0 |
0.000 |
| 8 |
8 |
|
N |
33 |
12 |
17696 |
◊ |
1 |
x,y,z |
1_555 |
28 |
8 |
16850 |
275.4 |
0.4 |
0.632 |
2 |
3 |
0 |
0.000 |
| 9 |
9 |
|
A |
26 |
8 |
17303 |
◊ |
A |
-x+1,y,-z |
2_655 |
26 |
8 |
17303 |
214.4 |
-1.9 |
0.403 |
2 |
4 |
0 |
0.000 |
| 10 |
10 |
|
A |
23 |
7 |
17303 |
x |
A |
x-1/2,-y+1,-z+1/2 |
4_465 |
19 |
5 |
17303 |
177.1 |
1.8 |
0.797 |
0 |
1 |
0 |
0.000 |
| 11 |
11 |
|
A |
19 |
8 |
17303 |
◊ |
1 |
x,y,z |
1_555 |
20 |
8 |
16850 |
162.3 |
0.1 |
0.560 |
0 |
0 |
0 |
0.000 |
| 12 |
12 |
|
A |
13 |
4 |
17303 |
◊ |
N |
x-1/2,-y+1,-z+1/2 |
4_465 |
15 |
4 |
17696 |
111.8 |
-0.9 |
0.457 |
0 |
0 |
0 |
0.000 |
| 13 |
13 |
|
[PO4]1:402 |
5 |
1 |
189 |
f |
1 |
x,y,z |
1_555 |
18 |
6 |
16850 |
100.1 |
-5.5 |
0.755 |
3 |
0 |
0 |
0.033 |
| 14 |
14 |
|
[PO4]1:403 |
5 |
1 |
187 |
f |
1 |
x,y,z |
1_555 |
14 |
5 |
16850 |
99.9 |
-6.4 |
0.751 |
2 |
0 |
0 |
0.035 |
| 15 |
15 |
|
N |
13 |
7 |
17696 |
◊ |
e |
x-1/2,-y+2,-z+1/2 |
4_475 |
10 |
5 |
16588 |
78.0 |
0.9 |
0.704 |
1 |
2 |
0 |
0.000 |
| 16 |
16 |
|
[PO4]1:405 |
5 |
1 |
189 |
f |
1 |
x,y,z |
1_555 |
11 |
5 |
16850 |
74.4 |
-4.6 |
0.765 |
2 |
0 |
0 |
0.027 |
| 17 |
17 |
|
N |
5 |
2 |
17696 |
x |
N |
x-1/2,-y+1,-z+1/2 |
4_465 |
8 |
3 |
17696 |
60.5 |
1.8 |
0.806 |
1 |
2 |
0 |
0.000 |
| 18 |
18 |
|
N |
4 |
2 |
17696 |
◊ |
A |
x-1/2,-y+1,-z+1/2 |
4_465 |
4 |
2 |
17303 |
58.1 |
1.0 |
0.835 |
0 |
0 |
0 |
0.000 |
| 19 |
19 |
|
[ZN]N:401 |
1 |
1 |
98 |
f |
N |
x,y,z |
1_555 |
17 |
9 |
17696 |
54.1 |
-28.5 |
0.000 |
0 |
0 |
0 |
0.335 |
20 |
|
[ZN]A:402 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
17303 |
53.1 |
-27.7 |
0.000 |
0 |
0 |
0 |
0.335 |
21 |
|
[ZN]1:404 |
1 |
1 |
98 |
f |
1 |
x,y,z |
1_555 |
17 |
9 |
16850 |
51.1 |
-24.8 |
0.000 |
0 |
0 |
0 |
0.335 |
| Average: |
52.7 |
-27.0 |
0.000 |
0 |
0 |
0 |
0.335 |
| 20 |
22 |
|
[ZN]e:402 |
1 |
1 |
98 |
f |
e |
x,y,z |
1_555 |
15 |
9 |
16588 |
53.7 |
-31.0 |
0.000 |
0 |
0 |
0 |
0.454 |
23 |
|
[ZN]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
17303 |
50.8 |
-37.1 |
0.000 |
0 |
0 |
0 |
0.454 |
24 |
|
[ZN]N:402 |
1 |
1 |
98 |
f |
N |
x,y,z |
1_555 |
11 |
6 |
17696 |
44.0 |
-32.2 |
0.000 |
0 |
0 |
0 |
0.454 |
25 |
|
[ZN]1:401 |
1 |
1 |
98 |
f |
1 |
x,y,z |
1_555 |
8 |
6 |
16850 |
43.4 |
-32.0 |
0.000 |
0 |
0 |
0 |
0.454 |
26 |
|
[ZN]e:401 |
1 |
1 |
98 |
f |
e |
x,y,z |
1_555 |
9 |
6 |
16588 |
43.2 |
-31.0 |
0.000 |
0 |
0 |
0 |
0.454 |
| Average: |
47.0 |
-32.7 |
0.000 |
0 |
0 |
0 |
0.454 |
| 21 |
27 |
|
[PO4]1:405 |
4 |
1 |
189 |
◊ |
e |
x,y,z |
1_555 |
9 |
2 |
16588 |
49.3 |
-3.2 |
0.603 |
0 |
0 |
0 |
0.015 |
| 22 |
28 |
|
[PO4]1:402 |
4 |
1 |
189 |
◊ |
e |
x,y,z |
1_555 |
8 |
6 |
16588 |
39.0 |
-0.9 |
0.932 |
1 |
0 |
0 |
0.007 |
| 23 |
29 |
|
e |
7 |
4 |
16588 |
◊ |
e |
-x+1,y,-z |
2_655 |
7 |
4 |
16588 |
27.8 |
-0.8 |
0.374 |
0 |
0 |
0 |
0.000 |
| 24 |
30 |
|
[PO4]1:402 |
3 |
1 |
189 |
f |
[ZN]1:404 |
x,y,z |
1_555 |
1 |
1 |
98 |
22.6 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.052 |
| 25 |
31 |
|
[ZN]e:402 |
1 |
1 |
98 |
f |
[ZN]e:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.3 |
-17.1 |
0.000 |
0 |
0 |
0 |
0.083 |
| 26 |
32 |
|
[ZN]A:402 |
1 |
1 |
98 |
◊ |
N |
x,y,z |
1_555 |
2 |
1 |
17696 |
19.3 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.046 |
| 27 |
33 |
|
[ZN]N:402 |
1 |
1 |
98 |
f |
[ZN]N:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
18.6 |
-14.9 |
0.000 |
0 |
0 |
0 |
0.089 |
| 28 |
34 |
|
[ZN]1:404 |
1 |
1 |
98 |
f |
[ZN]1:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
14.7 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.057 |
| 29 |
35 |
|
1 |
2 |
1 |
16850 |
◊ |
1 |
-x,y,-z |
2_555 |
2 |
1 |
16850 |
14.7 |
0.4 |
0.828 |
0 |
0 |
0 |
0.000 |
| 30 |
36 |
|
e |
1 |
1 |
16588 |
◊ |
1 |
-x+1,y,-z |
2_655 |
1 |
1 |
16850 |
6.6 |
0.5 |
0.901 |
0 |
0 |
0 |
0.000 |
| 31 |
37 |
|
[PO4]1:403 |
1 |
1 |
187 |
◊ |
e |
x,y,z |
1_555 |
2 |
1 |
16588 |
4.2 |
-0.3 |
0.658 |
0 |
0 |
0 |
0.001 |
| 32 |
38 |
|
e |
2 |
1 |
16588 |
◊ |
e |
-x,y,-z |
2_555 |
2 |
1 |
16588 |
4.1 |
0.3 |
0.772 |
0 |
0 |
0 |
0.000 |
| 33 |
39 |
|
[PO4]1:402 |
1 |
1 |
189 |
f |
[ZN]1:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
1.7 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.004 |
|