## |
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 |
266 |
68 |
20330 |
◊ |
A |
x,y,z |
1_555 |
273 |
69 |
20579 |
2614.1 |
-35.7 |
0.022 |
42 |
10 |
0 |
0.473 |
2 |
2 |
|
[HEM]B:801 |
42 |
1 |
826 |
f |
B |
x,y,z |
1_555 |
79 |
25 |
20330 |
538.4 |
-18.6 |
0.386 |
3 |
0 |
0 |
0.333 |
3 |
|
[HEM]A:801 |
42 |
1 |
830 |
f |
A |
x,y,z |
1_555 |
79 |
24 |
20579 |
537.5 |
-18.5 |
0.374 |
2 |
0 |
0 |
0.333 |
Average: |
538.0 |
-18.6 |
0.380 |
3 |
0 |
0 |
0.333 |
3 |
4 |
|
A |
43 |
10 |
20579 |
x |
A |
x-1,y,z |
1_455 |
45 |
12 |
20579 |
393.6 |
-1.1 |
0.626 |
1 |
0 |
0 |
0.000 |
4 |
5 |
|
[OT4]B:803 |
21 |
1 |
492 |
f |
B |
x,y,z |
1_555 |
34 |
16 |
20330 |
252.2 |
-2.8 |
0.362 |
3 |
0 |
0 |
0.067 |
6 |
|
[OT4]A:803 |
21 |
1 |
492 |
f |
A |
x,y,z |
1_555 |
32 |
15 |
20579 |
247.6 |
-2.4 |
0.385 |
3 |
0 |
0 |
0.067 |
Average: |
249.9 |
-2.6 |
0.374 |
3 |
0 |
0 |
0.067 |
5 |
7 |
|
[H4B]A:802 |
17 |
1 |
394 |
f |
A |
x,y,z |
1_555 |
31 |
9 |
20579 |
191.8 |
2.3 |
0.508 |
3 |
0 |
0 |
0.000 |
8 |
|
[H4B]B:802 |
17 |
1 |
393 |
f |
B |
x,y,z |
1_555 |
30 |
10 |
20330 |
191.5 |
2.1 |
0.517 |
2 |
0 |
0 |
0.000 |
Average: |
191.6 |
2.2 |
0.513 |
3 |
0 |
0 |
0.000 |
6 |
9 |
|
[OT4]A:803 |
20 |
1 |
492 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
35 |
1 |
830 |
167.5 |
-5.3 |
0.586 |
0 |
0 |
0 |
0.092 |
10 |
|
[OT4]B:803 |
20 |
1 |
492 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
35 |
1 |
826 |
159.5 |
-5.2 |
0.638 |
1 |
0 |
0 |
0.092 |
Average: |
163.5 |
-5.2 |
0.612 |
1 |
0 |
0 |
0.092 |
7 |
11 |
|
[H4B]A:802 |
15 |
1 |
394 |
◊ |
B |
x,y,z |
1_555 |
23 |
6 |
20330 |
121.1 |
-0.4 |
0.225 |
1 |
0 |
0 |
0.014 |
12 |
|
[H4B]B:802 |
14 |
1 |
393 |
◊ |
A |
x,y,z |
1_555 |
21 |
6 |
20579 |
116.9 |
-0.3 |
0.241 |
1 |
0 |
0 |
0.014 |
Average: |
119.0 |
-0.4 |
0.233 |
1 |
0 |
0 |
0.014 |
8 |
13 |
|
[H4B]B:802 |
5 |
1 |
393 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
6 |
1 |
826 |
43.2 |
-1.1 |
0.475 |
1 |
0 |
0 |
0.013 |
9 |
14 |
|
[H4B]A:802 |
5 |
1 |
394 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
6 |
1 |
830 |
39.5 |
-1.1 |
0.475 |
2 |
0 |
0 |
0.017 |
10 |
15 |
|
B |
3 |
1 |
20330 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
1 |
20579 |
35.4 |
0.4 |
0.732 |
1 |
0 |
0 |
0.000 |
11 |
16 |
|
[ZN]A:804 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20579 |
34.5 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.256 |
17 |
|
[ZN]A:804 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20330 |
34.4 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.256 |
Average: |
34.4 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.256 |
12 |
18 |
|
[OT4]B:803 |
1 |
1 |
492 |
f |
[H4B]B:802 |
x,y,z |
1_555 |
3 |
1 |
393 |
24.5 |
0.0 |
0.348 |
1 |
0 |
0 |
0.009 |
19 |
|
[OT4]A:803 |
2 |
1 |
492 |
f |
[H4B]A:802 |
x,y,z |
1_555 |
2 |
1 |
394 |
16.2 |
-0.2 |
0.354 |
1 |
0 |
0 |
0.009 |
Average: |
20.3 |
-0.1 |
0.351 |
1 |
0 |
0 |
0.009 |
|