## |
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 |
412 |
94 |
15961 |
◊ |
A |
x,y,z |
1_555 |
431 |
98 |
21410 |
4139.7 |
-52.1 |
0.003 |
57 |
11 |
0 |
0.655 |
2 |
2 |
|
C |
138 |
31 |
4875 |
◊ |
A |
x,y,z |
1_555 |
149 |
44 |
21410 |
1387.0 |
-12.6 |
0.096 |
20 |
4 |
0 |
0.403 |
3 |
3 |
|
B |
79 |
19 |
15961 |
◊ |
B |
y,x,-z |
4_555 |
77 |
19 |
15961 |
788.9 |
-0.5 |
0.702 |
8 |
6 |
0 |
0.000 |
4 |
4 |
|
A |
41 |
14 |
21410 |
◊ |
A |
y,x,-z |
4_555 |
40 |
14 |
21410 |
451.0 |
-2.9 |
0.420 |
2 |
6 |
0 |
0.000 |
5 |
5 |
|
B |
30 |
7 |
15961 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
26 |
7 |
21410 |
213.8 |
-1.9 |
0.438 |
1 |
0 |
0 |
0.000 |
6 |
6 |
|
C |
18 |
5 |
4875 |
◊ |
C |
-x,-x+y,-z+1/3 |
6_555 |
18 |
5 |
4875 |
178.4 |
1.2 |
0.758 |
2 |
0 |
0 |
0.000 |
7 |
7 |
|
C |
18 |
5 |
4875 |
◊ |
B |
x-y,-y+1,-z+2/3 |
5_565 |
16 |
7 |
15961 |
126.4 |
-1.6 |
0.378 |
0 |
0 |
0 |
0.000 |
8 |
8 |
|
[MCR]A:502 |
5 |
1 |
214 |
f |
A |
x,y,z |
1_555 |
30 |
13 |
21410 |
104.9 |
-1.1 |
0.415 |
0 |
0 |
0 |
0.021 |
9 |
9 |
|
B |
3 |
1 |
15961 |
◊ |
A |
x,y,z-1 |
1_554 |
8 |
4 |
21410 |
66.3 |
1.6 |
0.821 |
1 |
1 |
0 |
0.000 |
10 |
10 |
|
[SO4]B:331 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
15961 |
64.6 |
-7.3 |
0.940 |
4 |
0 |
0 |
0.100 |
11 |
11 |
|
[FE]A:500 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
21410 |
42.5 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.271 |
12 |
|
[FE]A:499 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
21410 |
40.3 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.271 |
Average: |
41.4 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.271 |
12 |
13 |
|
B |
5 |
3 |
15961 |
◊ |
C |
-y+1,x-y+1,z+1/3 |
2_665 |
4 |
1 |
4875 |
29.4 |
0.5 |
0.716 |
0 |
0 |
0 |
0.000 |
13 |
14 |
|
B |
2 |
2 |
15961 |
◊ |
A |
y,x,-z |
4_555 |
6 |
2 |
21410 |
27.4 |
0.3 |
0.668 |
0 |
0 |
0 |
0.000 |
14 |
15 |
|
[MCR]A:502 |
4 |
1 |
214 |
f |
[FE]A:499 |
x,y,z |
1_555 |
1 |
1 |
137 |
25.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.036 |
15 |
16 |
|
[MCR]A:502 |
4 |
1 |
214 |
f |
[FE]A:500 |
x,y,z |
1_555 |
1 |
1 |
137 |
25.0 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.034 |
16 |
17 |
|
[OH]A:501 |
1 |
1 |
99 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
21410 |
24.3 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.045 |
17 |
18 |
|
C |
2 |
1 |
4875 |
◊ |
A |
-x,-x+y,-z+1/3 |
6_555 |
2 |
1 |
21410 |
21.5 |
0.4 |
0.454 |
0 |
0 |
0 |
0.000 |
18 |
19 |
|
[FE]A:500 |
1 |
1 |
137 |
f |
[FE]A:499 |
x,y,z |
1_555 |
1 |
1 |
137 |
20.8 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.076 |
19 |
20 |
|
[OH]A:501 |
1 |
1 |
99 |
f |
[FE]A:499 |
x,y,z |
1_555 |
1 |
1 |
137 |
19.6 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.054 |
20 |
21 |
|
[OH]A:501 |
1 |
1 |
99 |
f |
[FE]A:500 |
x,y,z |
1_555 |
1 |
1 |
137 |
18.9 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.052 |
21 |
22 |
|
[MCR]A:502 |
3 |
1 |
214 |
f |
[OH]A:501 |
x,y,z |
1_555 |
1 |
1 |
99 |
15.4 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.009 |
22 |
23 |
|
A |
1 |
1 |
21410 |
◊ |
B |
-y+1,x-y+1,z+1/3 |
2_665 |
1 |
1 |
15961 |
1.2 |
0.0 |
0.613 |
0 |
0 |
0 |
0.000 |
|