## |
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 |
68 |
21 |
12875 |
◊ |
B |
-y-1,x-y-1,z+1/3 |
2_445 |
69 |
21 |
12888 |
650.0 |
-7.6 |
0.126 |
7 |
0 |
0 |
0.000 |
2 |
2 |
|
A |
62 |
18 |
12875 |
x |
A |
-x-1,-x+y-1,-z+1/3 |
6_445 |
65 |
21 |
12875 |
601.9 |
-4.3 |
0.233 |
6 |
0 |
0 |
0.000 |
3 |
|
B |
66 |
20 |
12888 |
x |
B |
y,x-1,-z |
4_545 |
63 |
17 |
12888 |
588.7 |
-4.5 |
0.230 |
6 |
0 |
0 |
0.000 |
Average: |
595.3 |
-4.4 |
0.232 |
6 |
0 |
0 |
0.000 |
3 |
4 |
|
B |
25 |
9 |
12888 |
◊ |
A |
x,y-1,z |
1_545 |
26 |
8 |
12875 |
215.1 |
-2.6 |
0.278 |
0 |
0 |
0 |
0.000 |
4 |
5 |
|
B |
19 |
5 |
12888 |
◊ |
A |
x,y,z |
1_555 |
26 |
8 |
12875 |
214.4 |
2.5 |
0.744 |
3 |
2 |
0 |
0.000 |
6 |
|
A |
18 |
5 |
12875 |
◊ |
B |
x-1,y,z |
1_455 |
20 |
7 |
12888 |
186.4 |
2.2 |
0.805 |
3 |
2 |
0 |
0.000 |
Average: |
200.4 |
2.3 |
0.774 |
3 |
2 |
0 |
0.000 |
5 |
7 |
|
B |
14 |
7 |
12888 |
◊ |
A |
-x-1,-x+y-1,-z+1/3 |
6_445 |
21 |
7 |
12875 |
150.0 |
-1.9 |
0.305 |
1 |
0 |
0 |
0.000 |
8 |
|
B |
18 |
5 |
12888 |
◊ |
A |
y,x,-z |
4_555 |
13 |
7 |
12875 |
130.5 |
-1.5 |
0.339 |
1 |
0 |
0 |
0.000 |
Average: |
140.2 |
-1.7 |
0.322 |
1 |
0 |
0 |
0.000 |
6 |
9 |
|
[CO3]B:402 |
4 |
1 |
164 |
f |
B |
x,y,z |
1_555 |
13 |
8 |
12888 |
78.4 |
2.3 |
0.725 |
6 |
0 |
0 |
0.003 |
7 |
10 |
|
[CO3]A:402 |
4 |
1 |
164 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
12875 |
78.0 |
3.4 |
0.752 |
6 |
0 |
0 |
0.000 |
8 |
11 |
|
[FE]B:401 |
1 |
1 |
137 |
cf |
B |
x,y,z |
1_555 |
10 |
7 |
12888 |
56.6 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.077 |
12 |
|
[FE]A:401 |
1 |
1 |
137 |
cf |
A |
x,y,z |
1_555 |
10 |
7 |
12875 |
56.3 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.077 |
Average: |
56.4 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.077 |
9 |
13 |
|
[CO3]A:402 |
3 |
1 |
164 |
f |
[FE]A:401 |
x,y,z |
1_555 |
1 |
1 |
137 |
37.0 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.028 |
10 |
14 |
|
[CO3]B:402 |
3 |
1 |
164 |
f |
[FE]B:401 |
x,y,z |
1_555 |
1 |
1 |
137 |
36.8 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.029 |
11 |
15 |
|
A |
5 |
2 |
12875 |
◊ |
A |
-x,-x+y,-z+1/3 |
6_555 |
5 |
2 |
12875 |
29.7 |
0.5 |
0.754 |
0 |
0 |
0 |
0.000 |
16 |
|
B |
7 |
6 |
12888 |
◊ |
B |
y+1,x-1,-z |
4_645 |
7 |
6 |
12888 |
23.9 |
0.7 |
0.765 |
0 |
0 |
0 |
0.000 |
Average: |
26.8 |
0.6 |
0.760 |
0 |
0 |
0 |
0.000 |
12 |
17 |
|
B |
3 |
2 |
12888 |
◊ |
A |
y,x-1,-z |
4_545 |
4 |
2 |
12875 |
28.2 |
0.3 |
0.715 |
1 |
0 |
0 |
0.000 |
18 |
|
B |
1 |
1 |
12888 |
◊ |
A |
-x,-x+y-1,-z+1/3 |
6_545 |
1 |
1 |
12875 |
2.5 |
0.1 |
0.731 |
0 |
0 |
0 |
0.000 |
Average: |
15.4 |
0.2 |
0.723 |
1 |
0 |
0 |
0.000 |
|