## |
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 |
70 |
20217 |
◊ |
A |
x,y,z |
1_555 |
257 |
69 |
19958 |
2621.8 |
-39.8 |
0.005 |
38 |
9 |
0 |
0.478 |
2 |
2 |
|
A |
67 |
19 |
19958 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
67 |
19 |
20217 |
654.2 |
-1.8 |
0.659 |
16 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]B:750 |
43 |
1 |
818 |
f |
B |
x,y,z |
1_555 |
80 |
24 |
20217 |
520.8 |
-18.2 |
0.341 |
1 |
0 |
0 |
0.309 |
4 |
|
[HEM]A:750 |
43 |
1 |
824 |
f |
A |
x,y,z |
1_555 |
79 |
24 |
19958 |
514.6 |
-18.0 |
0.353 |
2 |
0 |
0 |
0.309 |
Average: |
517.7 |
-18.1 |
0.347 |
2 |
0 |
0 |
0.309 |
4 |
5 |
|
B |
53 |
15 |
20217 |
x |
B |
x-1,y,z |
1_455 |
46 |
15 |
20217 |
455.5 |
1.0 |
0.767 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
39 |
11 |
20217 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
4_645 |
34 |
8 |
19958 |
317.4 |
-1.7 |
0.523 |
2 |
0 |
0 |
0.000 |
6 |
7 |
|
[ML6]A:800 |
23 |
1 |
565 |
f |
A |
x,y,z |
1_555 |
39 |
18 |
19958 |
293.6 |
-2.3 |
0.341 |
4 |
0 |
0 |
0.062 |
8 |
|
[ML6]B:800 |
22 |
1 |
561 |
f |
B |
x,y,z |
1_555 |
36 |
16 |
20217 |
281.8 |
-1.7 |
0.357 |
4 |
0 |
0 |
0.062 |
Average: |
287.7 |
-2.0 |
0.349 |
4 |
0 |
0 |
0.062 |
7 |
9 |
|
[H4B]A:760 |
17 |
1 |
401 |
f |
A |
x,y,z |
1_555 |
30 |
8 |
19958 |
199.1 |
2.1 |
0.486 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]B:760 |
17 |
1 |
400 |
f |
B |
x,y,z |
1_555 |
28 |
8 |
20217 |
198.6 |
1.8 |
0.426 |
2 |
0 |
0 |
0.000 |
Average: |
198.9 |
1.9 |
0.456 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
21 |
9 |
19958 |
◊ |
B |
-x,y-1/2,-z+1/2 |
4_545 |
25 |
8 |
20217 |
183.0 |
0.1 |
0.694 |
0 |
2 |
0 |
0.000 |
9 |
12 |
|
[ML6]B:800 |
17 |
1 |
561 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
34 |
1 |
818 |
154.5 |
-5.5 |
0.574 |
1 |
0 |
0 |
0.098 |
13 |
|
[ML6]A:800 |
17 |
1 |
565 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
34 |
1 |
824 |
149.8 |
-5.5 |
0.573 |
1 |
0 |
0 |
0.098 |
Average: |
152.2 |
-5.5 |
0.573 |
1 |
0 |
0 |
0.098 |
10 |
14 |
|
[H4B]B:760 |
13 |
1 |
400 |
◊ |
A |
x,y,z |
1_555 |
24 |
6 |
19958 |
119.5 |
-0.1 |
0.277 |
1 |
0 |
0 |
0.010 |
15 |
|
[H4B]A:760 |
13 |
1 |
401 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
20217 |
118.3 |
-0.1 |
0.263 |
1 |
0 |
0 |
0.010 |
Average: |
118.9 |
-0.1 |
0.270 |
1 |
0 |
0 |
0.010 |
11 |
16 |
|
[ACT]B:860 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
20217 |
119.0 |
-1.1 |
0.532 |
1 |
0 |
0 |
0.013 |
12 |
17 |
|
[ACT]A:860 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
19958 |
110.2 |
-1.4 |
0.487 |
1 |
0 |
0 |
0.015 |
13 |
18 |
|
[H4B]B:760 |
4 |
1 |
400 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
818 |
41.9 |
-1.1 |
0.475 |
2 |
0 |
0 |
0.029 |
19 |
|
[H4B]A:760 |
5 |
1 |
401 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
824 |
41.8 |
-1.1 |
0.433 |
1 |
0 |
0 |
0.029 |
Average: |
41.8 |
-1.1 |
0.454 |
2 |
0 |
0 |
0.029 |
14 |
20 |
|
[ML6]A:800 |
2 |
1 |
565 |
◊ |
B |
x,y,z |
1_555 |
6 |
1 |
20217 |
40.2 |
0.8 |
0.501 |
0 |
0 |
0 |
0.000 |
21 |
|
[ML6]B:800 |
2 |
1 |
561 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
19958 |
38.8 |
0.8 |
0.523 |
0 |
0 |
0 |
0.000 |
Average: |
39.5 |
0.8 |
0.512 |
0 |
0 |
0 |
0.000 |
15 |
22 |
|
[ACT]A:860 |
4 |
1 |
184 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
824 |
39.4 |
-1.2 |
0.749 |
0 |
0 |
0 |
0.010 |
16 |
23 |
|
[ZN]A:1717 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
19958 |
34.4 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.251 |
24 |
|
[ZN]A:1717 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20217 |
34.2 |
-20.1 |
0.000 |
0 |
0 |
0 |
0.251 |
Average: |
34.3 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.251 |
17 |
25 |
|
B |
2 |
2 |
20217 |
x |
B |
x-1/2,-y+1/2,-z+1 |
3_456 |
4 |
3 |
20217 |
20.6 |
1.1 |
0.894 |
0 |
0 |
0 |
0.000 |
18 |
26 |
|
[ACT]B:860 |
2 |
1 |
183 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
3 |
1 |
818 |
19.6 |
-0.1 |
0.832 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
A |
2 |
1 |
19958 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
20217 |
9.8 |
0.1 |
0.671 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[ML6]B:800 |
4 |
1 |
561 |
f |
[H4B]B:760 |
x,y,z |
1_555 |
1 |
1 |
400 |
8.4 |
-0.2 |
0.262 |
0 |
0 |
0 |
0.004 |
29 |
|
[ML6]A:800 |
3 |
1 |
565 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
1 |
1 |
401 |
8.2 |
-0.3 |
0.252 |
0 |
0 |
0 |
0.004 |
Average: |
8.3 |
-0.3 |
0.257 |
0 |
0 |
0 |
0.004 |
21 |
30 |
|
A |
1 |
1 |
19958 |
x |
A |
x-1/2,-y+1/2,-z |
3_455 |
1 |
1 |
19958 |
6.1 |
-0.2 |
0.302 |
0 |
0 |
0 |
0.000 |
|