## |
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 |
20492 |
◊ |
A |
x,y,z |
1_555 |
269 |
69 |
20137 |
2607.1 |
-38.3 |
0.011 |
36 |
12 |
0 |
0.444 |
2 |
2 |
|
A |
67 |
20 |
20137 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
68 |
19 |
20492 |
658.5 |
-1.4 |
0.703 |
10 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]A:750 |
43 |
1 |
827 |
f |
A |
x,y,z |
1_555 |
80 |
24 |
20137 |
523.7 |
-18.2 |
0.352 |
2 |
0 |
0 |
0.302 |
4 |
|
[HEM]B:750 |
43 |
1 |
825 |
f |
B |
x,y,z |
1_555 |
81 |
23 |
20492 |
520.9 |
-18.1 |
0.324 |
2 |
0 |
0 |
0.302 |
Average: |
522.3 |
-18.2 |
0.338 |
2 |
0 |
0 |
0.302 |
4 |
5 |
|
B |
49 |
15 |
20492 |
x |
B |
x-1,y,z |
1_455 |
49 |
14 |
20492 |
448.2 |
-0.1 |
0.734 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
39 |
12 |
20492 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
4_645 |
29 |
8 |
20137 |
292.4 |
-2.0 |
0.522 |
3 |
2 |
0 |
0.000 |
6 |
7 |
|
[M48]A:801 |
22 |
1 |
566 |
f |
A |
x,y,z |
1_555 |
36 |
16 |
20137 |
275.5 |
-4.8 |
0.295 |
3 |
0 |
0 |
0.087 |
8 |
|
[M48]B:801 |
23 |
1 |
561 |
f |
B |
x,y,z |
1_555 |
34 |
17 |
20492 |
273.8 |
-3.5 |
0.342 |
3 |
0 |
0 |
0.087 |
Average: |
274.6 |
-4.2 |
0.319 |
3 |
0 |
0 |
0.087 |
7 |
9 |
|
[H4B]A:760 |
17 |
1 |
400 |
f |
A |
x,y,z |
1_555 |
30 |
10 |
20137 |
198.2 |
1.8 |
0.448 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]B:760 |
17 |
1 |
402 |
f |
B |
x,y,z |
1_555 |
28 |
8 |
20492 |
197.3 |
1.9 |
0.452 |
2 |
0 |
0 |
0.000 |
Average: |
197.8 |
1.9 |
0.450 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
[M48]B:801 |
18 |
1 |
561 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
29 |
1 |
825 |
159.4 |
-6.0 |
0.659 |
1 |
0 |
0 |
0.100 |
12 |
|
[M48]A:801 |
17 |
1 |
566 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
31 |
1 |
827 |
159.4 |
-6.2 |
0.665 |
0 |
0 |
0 |
0.100 |
Average: |
159.4 |
-6.1 |
0.662 |
1 |
0 |
0 |
0.100 |
9 |
13 |
|
A |
14 |
7 |
20137 |
◊ |
B |
-x,y-1/2,-z+1/2 |
4_545 |
18 |
5 |
20492 |
127.7 |
-0.2 |
0.654 |
0 |
0 |
0 |
0.000 |
10 |
14 |
|
[H4B]B:760 |
13 |
1 |
402 |
◊ |
A |
x,y,z |
1_555 |
24 |
6 |
20137 |
121.1 |
-0.1 |
0.282 |
1 |
0 |
0 |
0.010 |
15 |
|
[H4B]A:760 |
14 |
1 |
400 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
20492 |
120.1 |
-0.2 |
0.247 |
1 |
0 |
0 |
0.010 |
Average: |
120.6 |
-0.2 |
0.264 |
1 |
0 |
0 |
0.010 |
11 |
16 |
|
[ACT]B:860 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
20492 |
115.4 |
-1.4 |
0.496 |
1 |
0 |
0 |
0.014 |
12 |
17 |
|
[ACT]A:860 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
20137 |
112.7 |
-1.3 |
0.500 |
1 |
0 |
0 |
0.014 |
13 |
18 |
|
[H4B]A:760 |
5 |
1 |
400 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
827 |
42.7 |
-1.3 |
0.416 |
1 |
0 |
0 |
0.031 |
19 |
|
[H4B]B:760 |
5 |
1 |
402 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
825 |
42.0 |
-1.3 |
0.411 |
2 |
0 |
0 |
0.031 |
Average: |
42.3 |
-1.3 |
0.413 |
2 |
0 |
0 |
0.031 |
14 |
20 |
|
[M48]A:801 |
4 |
1 |
566 |
◊ |
B |
x,y,z |
1_555 |
6 |
1 |
20492 |
38.1 |
0.4 |
0.495 |
0 |
0 |
0 |
0.000 |
21 |
|
[M48]B:801 |
3 |
1 |
561 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
20137 |
35.7 |
0.4 |
0.527 |
0 |
0 |
0 |
0.000 |
Average: |
36.9 |
0.4 |
0.511 |
0 |
0 |
0 |
0.000 |
15 |
22 |
|
[ZN]A:1717 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20492 |
34.7 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.243 |
23 |
|
[ZN]A:1717 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20137 |
34.4 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.243 |
Average: |
34.5 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.243 |
16 |
24 |
|
[ACT]A:860 |
3 |
1 |
182 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
827 |
34.7 |
-1.1 |
0.753 |
0 |
0 |
0 |
0.009 |
17 |
25 |
|
B |
4 |
2 |
20492 |
x |
B |
x-1/2,-y+1/2,-z+1 |
3_456 |
4 |
3 |
20492 |
32.0 |
1.4 |
0.885 |
0 |
0 |
0 |
0.000 |
18 |
26 |
|
[ACT]B:860 |
3 |
1 |
182 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
825 |
31.5 |
-1.0 |
0.761 |
0 |
0 |
0 |
0.008 |
19 |
27 |
|
A |
2 |
2 |
20137 |
◊ |
B |
x-1,y,z |
1_455 |
4 |
1 |
20492 |
13.4 |
0.1 |
0.671 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[M48]B:801 |
3 |
1 |
561 |
f |
[H4B]B:760 |
x,y,z |
1_555 |
1 |
1 |
402 |
10.7 |
-0.3 |
0.271 |
0 |
0 |
0 |
0.004 |
29 |
|
[M48]A:801 |
2 |
1 |
566 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
1 |
1 |
400 |
7.8 |
-0.2 |
0.277 |
0 |
0 |
0 |
0.004 |
Average: |
9.3 |
-0.3 |
0.274 |
0 |
0 |
0 |
0.004 |
|