## |
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 |
50 |
12 |
10402 |
◊ |
B |
-y+1/2,x+1/2,z+1/4 |
3_555 |
52 |
13 |
10804 |
455.0 |
-0.9 |
0.579 |
7 |
2 |
0 |
0.000 |
2 |
2 |
|
B |
52 |
13 |
10804 |
◊ |
A |
x,y,z |
1_555 |
52 |
14 |
10402 |
451.8 |
-4.6 |
0.256 |
4 |
1 |
0 |
0.000 |
3 |
3 |
|
B |
21 |
8 |
10804 |
◊ |
A |
x-1/2,-y+3/2,-z+3/4 |
6_465 |
25 |
9 |
10402 |
217.2 |
2.2 |
0.840 |
5 |
1 |
0 |
0.000 |
4 |
4 |
|
B |
24 |
10 |
10804 |
◊ |
A |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
25 |
7 |
10402 |
213.7 |
-0.1 |
0.607 |
1 |
0 |
0 |
0.000 |
5 |
5 |
|
[PPY]A:246 |
12 |
1 |
323 |
f |
A |
x,y,z |
1_555 |
34 |
19 |
10402 |
201.0 |
4.5 |
0.271 |
4 |
0 |
0 |
0.000 |
6 |
6 |
|
[PPY]B:246 |
12 |
1 |
319 |
f |
B |
x,y,z |
1_555 |
34 |
19 |
10804 |
192.1 |
4.8 |
0.394 |
5 |
0 |
0 |
0.000 |
7 |
7 |
|
B |
18 |
4 |
10804 |
x |
B |
x-1/2,-y+3/2,-z+3/4 |
6_465 |
22 |
9 |
10804 |
187.9 |
2.0 |
0.734 |
3 |
4 |
0 |
0.000 |
8 |
8 |
|
A |
23 |
6 |
10402 |
◊ |
B |
x,y-1,z |
1_545 |
25 |
9 |
10804 |
179.5 |
0.2 |
0.658 |
3 |
5 |
0 |
0.000 |
9 |
9 |
|
A |
16 |
4 |
10402 |
x |
A |
x-1/2,-y+1/2,-z+3/4 |
6_455 |
19 |
6 |
10402 |
146.6 |
-1.1 |
0.414 |
0 |
0 |
0 |
0.000 |
10 |
10 |
|
[FE]B:247 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
10804 |
65.7 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.028 |
11 |
11 |
|
[CO]B:244 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
10804 |
65.2 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.053 |
12 |
|
[CO]A:244 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
10402 |
64.8 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.053 |
Average: |
65.0 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.053 |
12 |
13 |
|
[CO]A:245 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
10402 |
47.9 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.043 |
14 |
|
[CO]B:245 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
10804 |
47.8 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.043 |
Average: |
47.9 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.043 |
13 |
15 |
|
A |
8 |
2 |
10402 |
◊ |
[FE]B:247 |
-y+1/2,x+1/2,z+1/4 |
3_555 |
1 |
1 |
137 |
44.6 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.000 |
14 |
16 |
|
[PPY]B:246 |
4 |
1 |
319 |
cf |
[CO]B:245 |
x,y,z |
1_555 |
1 |
1 |
125 |
37.9 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.012 |
15 |
17 |
|
[PPY]A:246 |
4 |
1 |
323 |
f |
[CO]A:245 |
x,y,z |
1_555 |
1 |
1 |
125 |
37.6 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.016 |
16 |
18 |
|
A |
3 |
2 |
10402 |
◊ |
A |
y,x,-z+1 |
7_556 |
3 |
2 |
10402 |
32.7 |
0.2 |
0.706 |
0 |
0 |
0 |
0.000 |
|