| ## |
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 |
263 |
70 |
19678 |
◊ |
A |
-y+1,-x+1,-z+5/6 |
10_665 |
258 |
70 |
19678 |
2583.4 |
-29.1 |
0.068 |
30 |
12 |
0 |
0.423 |
2 |
|
B |
260 |
69 |
19671 |
◊ |
B |
-x,-x+y,-z-1/3 |
9_554 |
259 |
69 |
19671 |
2568.3 |
-25.3 |
0.098 |
41 |
14 |
0 |
0.423 |
| Average: |
2575.8 |
-27.2 |
0.083 |
36 |
13 |
0 |
0.423 |
| 2 |
3 |
|
[HEM]A:900 |
43 |
1 |
815 |
f |
A |
x,y,z |
1_555 |
78 |
24 |
19678 |
537.3 |
-19.0 |
0.260 |
1 |
0 |
0 |
0.360 |
4 |
|
[HEM]B:900 |
43 |
1 |
817 |
f |
B |
x,y,z |
1_555 |
78 |
23 |
19671 |
533.1 |
-18.5 |
0.284 |
1 |
0 |
0 |
0.360 |
| Average: |
535.2 |
-18.7 |
0.272 |
1 |
0 |
0 |
0.360 |
| 3 |
5 |
|
B |
41 |
13 |
19671 |
◊ |
B |
-y+1,-x+1,-z-1/6 |
10_664 |
41 |
13 |
19671 |
373.3 |
-3.2 |
0.409 |
2 |
0 |
0 |
0.000 |
6 |
|
A |
41 |
12 |
19678 |
◊ |
A |
-x,-x+y,-z+2/3 |
9_555 |
41 |
12 |
19678 |
365.0 |
-2.7 |
0.491 |
0 |
0 |
0 |
0.000 |
| Average: |
369.2 |
-2.9 |
0.450 |
1 |
0 |
0 |
0.000 |
| 4 |
7 |
|
[ARR]B:903 |
25 |
1 |
605 |
f |
B |
x,y,z |
1_555 |
52 |
20 |
19671 |
347.0 |
-5.4 |
0.508 |
3 |
0 |
0 |
0.125 |
8 |
|
[ARR]A:902 |
25 |
1 |
605 |
f |
A |
x,y,z |
1_555 |
52 |
19 |
19678 |
333.1 |
-5.4 |
0.519 |
3 |
0 |
0 |
0.125 |
| Average: |
340.1 |
-5.4 |
0.514 |
3 |
0 |
0 |
0.125 |
| 5 |
9 |
|
B |
36 |
12 |
19671 |
◊ |
A |
x,x-y+1,-z+1/6 |
12_565 |
36 |
10 |
19678 |
280.2 |
-3.4 |
0.337 |
1 |
0 |
0 |
0.000 |
| 6 |
10 |
|
[H4B]B:1901 |
17 |
1 |
400 |
f |
B |
x,y,z |
1_555 |
29 |
10 |
19671 |
210.5 |
2.0 |
0.464 |
2 |
0 |
0 |
0.000 |
11 |
|
[H4B]A:901 |
17 |
1 |
400 |
f |
A |
x,y,z |
1_555 |
29 |
9 |
19678 |
207.5 |
2.1 |
0.490 |
3 |
0 |
0 |
0.000 |
| Average: |
209.0 |
2.1 |
0.477 |
3 |
0 |
0 |
0.000 |
| 7 |
12 |
|
[ARR]B:903 |
19 |
1 |
605 |
f |
[HEM]B:900 |
x,y,z |
1_555 |
36 |
1 |
817 |
160.3 |
-3.0 |
0.856 |
1 |
0 |
0 |
0.065 |
13 |
|
[ARR]A:902 |
21 |
1 |
605 |
f |
[HEM]A:900 |
x,y,z |
1_555 |
34 |
1 |
815 |
160.0 |
-3.0 |
0.862 |
1 |
0 |
0 |
0.065 |
| Average: |
160.1 |
-3.0 |
0.859 |
1 |
0 |
0 |
0.065 |
| 8 |
14 |
|
[H4B]B:1901 |
13 |
1 |
400 |
◊ |
B |
-x,-x+y,-z-1/3 |
9_554 |
21 |
6 |
19671 |
117.1 |
-0.1 |
0.260 |
1 |
0 |
0 |
0.010 |
15 |
|
[H4B]A:901 |
13 |
1 |
400 |
◊ |
A |
-y+1,-x+1,-z+5/6 |
10_665 |
20 |
6 |
19678 |
113.8 |
-0.1 |
0.257 |
1 |
0 |
0 |
0.010 |
| Average: |
115.4 |
-0.1 |
0.259 |
1 |
0 |
0 |
0.010 |
| 9 |
16 |
|
B |
14 |
6 |
19671 |
◊ |
A |
x,y,z |
1_555 |
13 |
6 |
19678 |
94.7 |
-1.7 |
0.330 |
0 |
0 |
0 |
0.000 |
| 10 |
17 |
|
[H4B]A:901 |
5 |
1 |
400 |
f |
[HEM]A:900 |
x,y,z |
1_555 |
5 |
1 |
815 |
44.3 |
-1.3 |
0.416 |
2 |
0 |
0 |
0.042 |
18 |
|
[H4B]B:1901 |
4 |
1 |
400 |
f |
[HEM]B:900 |
x,y,z |
1_555 |
5 |
1 |
817 |
39.7 |
-1.4 |
0.436 |
2 |
0 |
0 |
0.042 |
| Average: |
42.0 |
-1.3 |
0.426 |
2 |
0 |
0 |
0.042 |
| 11 |
19 |
|
[ZN]A:950 |
1 |
1 |
98 |
x |
A |
x,y,z |
1_555 |
5 |
3 |
19678 |
40.5 |
-25.0 |
0.000 |
0 |
0 |
0 |
0.422 |
20 |
|
[ZN]B:950 |
1 |
1 |
98 |
x |
B |
x,y,z |
1_555 |
5 |
3 |
19671 |
40.0 |
-25.1 |
0.000 |
0 |
0 |
0 |
0.422 |
| Average: |
40.2 |
-25.1 |
0.000 |
0 |
0 |
0 |
0.422 |
| 12 |
21 |
|
[ZN]A:950 |
1 |
1 |
98 |
f |
[ZN]A:950 |
-y+1,-x+1,-z+5/6 |
10_665 |
1 |
1 |
98 |
37.1 |
-29.7 |
0.000 |
0 |
0 |
0 |
0.125 |
| 13 |
22 |
|
[ZN]B:950 |
1 |
1 |
98 |
f |
[ZN]B:950 |
-x,-x+y,-z-1/3 |
9_554 |
1 |
1 |
98 |
36.7 |
-29.4 |
0.000 |
0 |
0 |
0 |
0.124 |
| 14 |
23 |
|
[ARR]B:903 |
2 |
1 |
605 |
◊ |
B |
-x,-x+y,-z-1/3 |
9_554 |
2 |
1 |
19671 |
9.9 |
-0.3 |
0.388 |
0 |
0 |
0 |
0.006 |
24 |
|
[ARR]A:902 |
2 |
1 |
605 |
◊ |
A |
-y+1,-x+1,-z+5/6 |
10_665 |
2 |
1 |
19678 |
8.7 |
-0.3 |
0.447 |
0 |
0 |
0 |
0.006 |
| Average: |
9.3 |
-0.3 |
0.418 |
0 |
0 |
0 |
0.006 |
|