| ## |
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 |
269 |
71 |
20309 |
◊ |
A |
x,y,z |
1_555 |
274 |
69 |
20752 |
2638.1 |
-41.1 |
0.006 |
40 |
7 |
0 |
0.454 |
| 2 |
2 |
|
[HEM]A:801 |
41 |
1 |
829 |
f |
A |
x,y,z |
1_555 |
78 |
24 |
20752 |
531.1 |
-18.9 |
0.312 |
2 |
0 |
0 |
0.300 |
3 |
|
[HEM]B:801 |
41 |
1 |
830 |
f |
B |
x,y,z |
1_555 |
77 |
23 |
20309 |
526.9 |
-18.9 |
0.305 |
2 |
0 |
0 |
0.300 |
| Average: |
529.0 |
-18.9 |
0.309 |
2 |
0 |
0 |
0.300 |
| 3 |
4 |
|
A |
46 |
12 |
20752 |
x |
A |
x-1,y,z |
1_455 |
42 |
13 |
20752 |
365.6 |
-0.6 |
0.703 |
2 |
0 |
0 |
0.000 |
| 4 |
5 |
|
[8F1]A:803 |
25 |
1 |
614 |
f |
A |
x,y,z |
1_555 |
51 |
22 |
20752 |
344.5 |
-3.6 |
0.541 |
3 |
0 |
0 |
0.077 |
6 |
|
[8F1]B:803 |
26 |
1 |
617 |
f |
B |
x,y,z |
1_555 |
48 |
21 |
20309 |
338.3 |
-3.9 |
0.502 |
3 |
0 |
0 |
0.077 |
| Average: |
341.4 |
-3.8 |
0.521 |
3 |
0 |
0 |
0.077 |
| 5 |
7 |
|
[H4B]A:802 |
17 |
1 |
396 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
20752 |
197.4 |
2.2 |
0.491 |
2 |
0 |
0 |
0.000 |
8 |
|
[H4B]B:802 |
17 |
1 |
398 |
f |
B |
x,y,z |
1_555 |
29 |
9 |
20309 |
197.0 |
2.1 |
0.493 |
2 |
0 |
0 |
0.000 |
| Average: |
197.2 |
2.1 |
0.492 |
2 |
0 |
0 |
0.000 |
| 6 |
9 |
|
[8F1]B:803 |
23 |
1 |
617 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
38 |
1 |
830 |
176.8 |
-6.2 |
0.854 |
0 |
0 |
0 |
0.093 |
10 |
|
[8F1]A:803 |
25 |
1 |
614 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
36 |
1 |
829 |
173.5 |
-6.1 |
0.865 |
0 |
0 |
0 |
0.093 |
| Average: |
175.2 |
-6.2 |
0.859 |
0 |
0 |
0 |
0.093 |
| 7 |
11 |
|
[GOL]B:804 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
23 |
11 |
20309 |
142.1 |
-0.7 |
0.537 |
1 |
0 |
0 |
0.009 |
| 8 |
12 |
|
[GOL]A:805 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
22 |
10 |
20752 |
136.9 |
-0.2 |
0.645 |
4 |
0 |
0 |
0.015 |
| 9 |
13 |
|
[H4B]B:802 |
14 |
1 |
398 |
◊ |
A |
x,y,z |
1_555 |
23 |
6 |
20752 |
119.9 |
-0.0 |
0.277 |
1 |
0 |
0 |
0.008 |
14 |
|
[H4B]A:802 |
14 |
1 |
396 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
20309 |
117.4 |
-0.1 |
0.251 |
1 |
0 |
0 |
0.008 |
| Average: |
118.7 |
-0.1 |
0.264 |
1 |
0 |
0 |
0.008 |
| 10 |
15 |
|
[GOL]B:805 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
12 |
3 |
20309 |
83.2 |
0.4 |
0.655 |
4 |
0 |
0 |
0.011 |
| 11 |
16 |
|
[GOL]A:806 |
5 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
20752 |
77.9 |
-0.8 |
0.509 |
1 |
0 |
0 |
0.009 |
| 12 |
17 |
|
[GOL]A:804 |
4 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
20752 |
61.7 |
0.0 |
0.557 |
1 |
0 |
0 |
0.003 |
| 13 |
18 |
|
[GOL]B:805 |
6 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
20752 |
59.9 |
0.8 |
0.743 |
2 |
0 |
0 |
0.000 |
| 14 |
19 |
|
[H4B]B:802 |
4 |
1 |
398 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
5 |
1 |
830 |
41.9 |
-1.2 |
0.453 |
2 |
0 |
0 |
0.032 |
20 |
|
[H4B]A:802 |
5 |
1 |
396 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
5 |
1 |
829 |
41.4 |
-1.2 |
0.424 |
2 |
0 |
0 |
0.032 |
| Average: |
41.7 |
-1.2 |
0.439 |
2 |
0 |
0 |
0.032 |
| 15 |
21 |
|
B |
5 |
2 |
20309 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
2 |
20752 |
40.6 |
0.4 |
0.684 |
1 |
0 |
0 |
0.000 |
| 16 |
22 |
|
A |
7 |
3 |
20752 |
◊ |
[GOL]A:806 |
x-1,y,z |
1_455 |
4 |
1 |
218 |
40.6 |
0.2 |
0.652 |
2 |
0 |
0 |
0.000 |
| 17 |
23 |
|
[ZN]A:807 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20752 |
34.5 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.235 |
24 |
|
[ZN]A:807 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20309 |
34.2 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.235 |
| Average: |
34.3 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.235 |
| 18 |
25 |
|
[8F1]B:803 |
3 |
1 |
617 |
f |
[H4B]B:802 |
x,y,z |
1_555 |
2 |
1 |
398 |
17.1 |
-0.6 |
0.334 |
0 |
0 |
0 |
0.008 |
26 |
|
[8F1]A:803 |
3 |
1 |
614 |
f |
[H4B]A:802 |
x,y,z |
1_555 |
2 |
1 |
396 |
16.4 |
-0.4 |
0.361 |
0 |
0 |
0 |
0.008 |
| Average: |
16.7 |
-0.5 |
0.347 |
0 |
0 |
0 |
0.008 |
|