| ## |
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 |
|
B |
408 |
104 |
17327 |
◊ |
A |
x,y,z |
1_555 |
391 |
104 |
17222 |
3858.3 |
-27.9 |
0.290 |
48 |
15 |
0 |
0.165 |
| 2 |
2 |
|
B |
68 |
25 |
17327 |
◊ |
B |
x,x-y-1,-z+1/2 |
12_545 |
69 |
24 |
17327 |
671.0 |
5.2 |
0.967 |
5 |
4 |
0 |
0.000 |
| 3 |
3 |
|
B |
72 |
28 |
17327 |
◊ |
B |
-x,-x+y,-z |
9_555 |
72 |
28 |
17327 |
604.8 |
1.4 |
0.868 |
3 |
6 |
0 |
0.000 |
4 |
|
A |
50 |
19 |
17222 |
◊ |
A |
-y,-x,-z+1/2 |
8_555 |
51 |
19 |
17222 |
468.9 |
-1.9 |
0.606 |
1 |
6 |
0 |
0.000 |
| Average: |
536.9 |
-0.2 |
0.737 |
2 |
6 |
0 |
0.000 |
| 4 |
5 |
|
B |
34 |
10 |
17327 |
◊ |
A |
-x,-x+y,-z |
9_555 |
34 |
10 |
17222 |
321.2 |
3.8 |
0.936 |
3 |
7 |
0 |
0.000 |
6 |
|
B |
32 |
10 |
17327 |
◊ |
A |
-y,-x,-z+1/2 |
8_555 |
33 |
12 |
17222 |
267.7 |
1.3 |
0.798 |
1 |
1 |
0 |
0.000 |
| Average: |
294.4 |
2.6 |
0.867 |
2 |
4 |
0 |
0.000 |
| 5 |
7 |
|
B |
28 |
8 |
17327 |
◊ |
A |
-y,x-y-1,z |
3_545 |
34 |
13 |
17222 |
279.7 |
1.4 |
0.847 |
2 |
4 |
0 |
0.000 |
| 6 |
8 |
|
A |
18 |
6 |
17222 |
x |
A |
-y,x-y-1,z |
3_545 |
20 |
6 |
17222 |
152.1 |
0.0 |
0.651 |
1 |
0 |
0 |
0.000 |
| 7 |
9 |
|
A |
22 |
5 |
17222 |
◊ |
B |
x-y,x,z-1/2 |
2_554 |
17 |
4 |
17327 |
143.8 |
-0.7 |
0.574 |
0 |
0 |
0 |
0.000 |
| 8 |
10 |
|
A |
19 |
6 |
17222 |
◊ |
A |
x,x-y-1,-z+1/2 |
12_545 |
18 |
6 |
17222 |
128.6 |
2.8 |
0.940 |
2 |
4 |
0 |
0.000 |
| 9 |
11 |
|
[PO4]A:501 |
5 |
1 |
190 |
f |
A |
x,y,z |
1_555 |
20 |
10 |
17222 |
95.0 |
-7.2 |
0.428 |
4 |
0 |
0 |
0.057 |
12 |
|
[PO4]B:501 |
5 |
1 |
190 |
f |
B |
x,y,z |
1_555 |
20 |
10 |
17327 |
94.2 |
-6.5 |
0.537 |
5 |
0 |
0 |
0.057 |
| Average: |
94.6 |
-6.8 |
0.483 |
5 |
0 |
0 |
0.057 |
| 10 |
13 |
|
[ZN]B:504 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
5 |
3 |
17327 |
39.9 |
-31.5 |
0.000 |
0 |
0 |
0 |
0.201 |
14 |
|
[ZN]A:504 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
4 |
3 |
17222 |
39.7 |
-31.2 |
0.000 |
0 |
0 |
0 |
0.201 |
| Average: |
39.8 |
-31.3 |
0.000 |
0 |
0 |
0 |
0.201 |
| 11 |
15 |
|
[ZN]A:503 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
17222 |
35.5 |
-25.1 |
0.000 |
0 |
0 |
0 |
0.159 |
16 |
|
[ZN]B:503 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
9 |
6 |
17327 |
35.4 |
-24.5 |
0.000 |
0 |
0 |
0 |
0.159 |
| Average: |
35.4 |
-24.8 |
0.000 |
0 |
0 |
0 |
0.159 |
| 12 |
17 |
|
[ZN]A:502 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
9 |
5 |
17222 |
33.9 |
-25.7 |
0.000 |
0 |
0 |
0 |
0.164 |
18 |
|
[ZN]B:502 |
1 |
1 |
98 |
cf |
B |
x,y,z |
1_555 |
11 |
6 |
17327 |
33.5 |
-25.3 |
0.000 |
0 |
0 |
0 |
0.164 |
| Average: |
33.7 |
-25.5 |
0.000 |
0 |
0 |
0 |
0.164 |
| 13 |
19 |
|
[ZN]B:503 |
1 |
1 |
98 |
f |
[PO4]B:501 |
x,y,z |
1_555 |
3 |
1 |
190 |
25.2 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.077 |
20 |
|
[ZN]A:503 |
1 |
1 |
98 |
f |
[PO4]A:501 |
x,y,z |
1_555 |
3 |
1 |
190 |
25.2 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.077 |
| Average: |
25.2 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.077 |
| 14 |
21 |
|
[ZN]B:502 |
1 |
1 |
98 |
f |
[PO4]B:501 |
x,y,z |
1_555 |
3 |
1 |
190 |
23.1 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.064 |
22 |
|
[ZN]A:502 |
1 |
1 |
98 |
f |
[PO4]A:501 |
x,y,z |
1_555 |
3 |
1 |
190 |
23.0 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.064 |
| Average: |
23.1 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.064 |
| 15 |
23 |
|
[ZN]A:504 |
1 |
1 |
98 |
f |
[PO4]A:501 |
x,y,z |
1_555 |
2 |
1 |
190 |
13.8 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.040 |
24 |
|
[ZN]B:504 |
1 |
1 |
98 |
f |
[PO4]B:501 |
x,y,z |
1_555 |
1 |
1 |
190 |
13.4 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.040 |
| Average: |
13.6 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.040 |
| 16 |
25 |
|
[ZN]B:503 |
1 |
1 |
98 |
f |
[ZN]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.0 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.023 |
| 17 |
26 |
|
[ZN]A:503 |
1 |
1 |
98 |
f |
[ZN]A:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
8.9 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.023 |
| 18 |
27 |
|
[ZN]A:504 |
1 |
1 |
98 |
f |
[ZN]A:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
5.3 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.014 |
| 19 |
28 |
|
[ZN]B:504 |
1 |
1 |
98 |
f |
[ZN]B:502 |
x,y,z |
1_555 |
1 |
1 |
98 |
5.2 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.013 |
|