## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
90 |
22 |
9563 |
◊ |
A |
x,y,z |
1_555 |
91 |
22 |
9443 |
853.1 |
-13.0 |
0.038 |
11 |
4 |
0 |
1.000 |
2 |
|
A |
62 |
21 |
9443 |
x |
A |
x-1/2,-y+1/2,-z |
8_455 |
50 |
15 |
9443 |
475.9 |
-1.6 |
0.502 |
4 |
3 |
0 |
0.000 |
3 |
|
B |
40 |
12 |
9563 |
◊ |
B |
-x,y,-z+1/2 |
3_555 |
41 |
12 |
9563 |
377.1 |
-0.9 |
0.569 |
2 |
0 |
0 |
0.000 |
4 |
|
B |
17 |
8 |
9563 |
x |
B |
x-1/2,y+1/2,z |
5_455 |
17 |
7 |
9563 |
154.7 |
-0.6 |
0.455 |
1 |
2 |
0 |
0.000 |
5 |
|
B |
8 |
3 |
9563 |
x |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
7 |
2 |
9563 |
80.0 |
0.2 |
0.528 |
0 |
0 |
0 |
0.000 |
6 |
|
B |
8 |
4 |
9563 |
◊ |
A |
x-1,y,z |
1_455 |
6 |
4 |
9443 |
64.9 |
-0.1 |
0.543 |
1 |
0 |
0 |
0.000 |
7 |
|
A |
11 |
5 |
9443 |
x |
A |
x-1/2,y-1/2,z |
5_445 |
10 |
6 |
9443 |
55.3 |
-0.0 |
0.597 |
0 |
0 |
0 |
0.000 |
8 |
|
B |
5 |
2 |
9563 |
◊ |
A |
x-1/2,y+1/2,z |
5_455 |
7 |
3 |
9443 |
51.7 |
0.4 |
0.696 |
1 |
0 |
0 |
0.000 |
9 |
|
B |
8 |
3 |
9563 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
8 |
3 |
9563 |
50.7 |
0.4 |
0.707 |
0 |
0 |
0 |
0.000 |
10 |
|
[FE]B:206 |
1 |
1 |
137 |
f |
[OH]B:208 |
x,y,z |
1_555 |
1 |
1 |
99 |
38.6 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.042 |
11 |
|
[FE]A:206 |
1 |
1 |
137 |
f |
[OH]A:207 |
x,y,z |
1_555 |
1 |
1 |
99 |
36.3 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.100 |
12 |
|
[FE]B:206 |
1 |
1 |
137 |
f |
[OH]B:207 |
x,y,z |
1_555 |
1 |
1 |
99 |
36.2 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.040 |
13 |
|
A |
6 |
3 |
9443 |
◊ |
A |
x,-y,-z |
4_555 |
6 |
3 |
9443 |
34.6 |
0.7 |
0.770 |
0 |
0 |
0 |
0.000 |
14 |
|
[OH]B:208 |
1 |
1 |
99 |
f |
[OH]B:207 |
x,y,z |
1_555 |
1 |
1 |
99 |
23.4 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.019 |
|