| ## |
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 |
77 |
23 |
32762 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
95 |
25 |
31585 |
757.2 |
-8.3 |
0.213 |
6 |
0 |
0 |
0.000 |
| 2 |
2 |
|
C |
61 |
9 |
1400 |
◊ |
B |
x,y,z |
1_555 |
79 |
28 |
32762 |
629.4 |
-3.5 |
0.568 |
9 |
0 |
0 |
0.119 |
| 3 |
3 |
|
B |
64 |
22 |
32762 |
◊ |
A |
x,y,z |
1_555 |
66 |
21 |
31585 |
573.5 |
-8.4 |
0.095 |
3 |
0 |
0 |
0.009 |
| 4 |
4 |
|
B |
51 |
15 |
32762 |
x |
B |
-x-1/2,y-1/2,-z |
4_445 |
59 |
19 |
32762 |
513.9 |
-3.1 |
0.446 |
7 |
0 |
0 |
0.000 |
| 5 |
5 |
|
B |
62 |
14 |
32762 |
◊ |
A |
-x,y,-z+1 |
2_556 |
53 |
16 |
31585 |
470.0 |
-2.5 |
0.530 |
4 |
1 |
0 |
0.000 |
| 6 |
6 |
|
A |
46 |
12 |
31585 |
◊ |
A |
-x,y,-z |
2_555 |
46 |
12 |
31585 |
448.4 |
2.4 |
0.902 |
16 |
8 |
0 |
0.000 |
| 7 |
7 |
|
A |
46 |
14 |
31585 |
x |
A |
-x+1/2,y-1/2,-z+1 |
4_546 |
42 |
11 |
31585 |
417.6 |
-1.4 |
0.537 |
4 |
6 |
0 |
0.000 |
| 8 |
8 |
|
B |
42 |
10 |
32762 |
◊ |
A |
-x,y,-z |
2_555 |
50 |
15 |
31585 |
398.4 |
-1.2 |
0.578 |
3 |
0 |
0 |
0.000 |
| 9 |
9 |
|
[N8E]A:1816 |
24 |
1 |
724 |
f |
A |
x,y,z |
1_555 |
52 |
16 |
31585 |
336.2 |
-9.2 |
0.265 |
0 |
0 |
0 |
0.015 |
| 10 |
10 |
|
[N8E]A:1817 |
23 |
1 |
737 |
f |
B |
x,y,z |
1_555 |
47 |
15 |
32762 |
317.3 |
-6.5 |
0.445 |
0 |
0 |
0 |
0.104 |
| 11 |
11 |
|
[N8E]A:1817 |
24 |
1 |
737 |
◊ |
A |
x,y,z |
1_555 |
33 |
14 |
31585 |
261.4 |
-5.1 |
0.357 |
0 |
0 |
0 |
0.004 |
| 12 |
12 |
|
[FH7]C:11 |
11 |
1 |
333 |
◊ |
B |
x,y,z |
1_555 |
22 |
7 |
32762 |
137.2 |
-2.5 |
0.282 |
1 |
0 |
0 |
0.047 |
| 13 |
13 |
|
[FH7]C:11 |
11 |
1 |
333 |
cf |
C |
x,y,z |
1_555 |
25 |
7 |
1400 |
127.6 |
0.3 |
0.774 |
3 |
0 |
0 |
0.016 |
| 14 |
14 |
|
[PO4]B:1820 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
32762 |
121.8 |
-8.3 |
0.748 |
3 |
0 |
0 |
0.153 |
| 15 |
15 |
|
[PO4]A:1822 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
21 |
8 |
31585 |
119.4 |
-5.7 |
0.825 |
3 |
0 |
0 |
0.012 |
| 16 |
16 |
|
[PO4]B:1819 |
5 |
1 |
190 |
f |
B |
x,y,z |
1_555 |
15 |
10 |
32762 |
116.4 |
-6.1 |
0.833 |
5 |
0 |
0 |
0.132 |
17 |
|
[PO4]A:1819 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
14 |
10 |
31585 |
112.8 |
-5.8 |
0.841 |
8 |
0 |
0 |
0.132 |
| Average: |
114.6 |
-5.9 |
0.837 |
7 |
0 |
0 |
0.132 |
| 17 |
18 |
|
[PO4]A:1823 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
31585 |
105.8 |
-6.5 |
0.798 |
4 |
0 |
0 |
0.014 |
| 18 |
19 |
|
[PO4]A:1818 |
5 |
1 |
190 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
31585 |
104.7 |
-6.7 |
0.768 |
6 |
0 |
0 |
0.015 |
| 19 |
20 |
|
[PO4]B:1818 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
32762 |
104.2 |
-7.0 |
0.650 |
3 |
0 |
0 |
0.132 |
| 20 |
21 |
|
C |
10 |
3 |
1400 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
11 |
4 |
31585 |
99.5 |
-1.4 |
0.403 |
0 |
0 |
0 |
0.000 |
| 21 |
22 |
|
[PO4]A:1820 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
31585 |
93.8 |
-5.8 |
0.779 |
1 |
0 |
0 |
0.010 |
| 22 |
23 |
|
[PO4]A:1821 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
31585 |
88.4 |
-3.8 |
0.948 |
3 |
0 |
0 |
0.008 |
| 23 |
24 |
|
[PO4]B:1821 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
32762 |
83.4 |
-4.8 |
0.804 |
1 |
0 |
0 |
0.084 |
| 24 |
25 |
|
[FE]C:2 |
1 |
1 |
137 |
◊ |
B |
x,y,z |
1_555 |
13 |
7 |
32762 |
49.6 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.084 |
| 25 |
26 |
|
[FE]C:2 |
1 |
1 |
137 |
f |
C |
x,y,z |
1_555 |
10 |
2 |
1400 |
40.8 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.087 |
| 26 |
27 |
|
C |
6 |
3 |
1400 |
◊ |
B |
-x-1/2,y-1/2,-z |
4_445 |
2 |
1 |
32762 |
40.5 |
1.2 |
0.843 |
2 |
0 |
0 |
0.000 |
| 27 |
28 |
|
B |
4 |
3 |
32762 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
7 |
4 |
31585 |
34.5 |
1.2 |
0.873 |
1 |
0 |
0 |
0.000 |
| 28 |
29 |
|
[PO4]A:1822 |
4 |
1 |
188 |
f |
[PO4]A:1820 |
x,y,z |
1_555 |
4 |
1 |
188 |
34.0 |
-3.1 |
0.973 |
0 |
0 |
0 |
0.005 |
| 29 |
30 |
|
[PO4]A:1823 |
4 |
1 |
188 |
f |
[PO4]A:1820 |
x,y,z |
1_555 |
4 |
1 |
188 |
33.2 |
-3.2 |
0.973 |
0 |
0 |
0 |
0.005 |
| 30 |
31 |
|
[FE]C:2 |
1 |
1 |
137 |
f |
[FH7]C:11 |
x,y,z |
1_555 |
4 |
1 |
333 |
32.3 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.042 |
| 31 |
32 |
|
[FH7]C:11 |
1 |
1 |
333 |
◊ |
A |
x-1/2,y-1/2,z |
3_445 |
1 |
1 |
31585 |
0.4 |
-0.0 |
0.542 |
0 |
0 |
0 |
0.000 |
|