| ## |
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 |
265 |
68 |
20081 |
◊ |
A |
x,y,z |
1_555 |
263 |
68 |
19895 |
2565.3 |
-40.2 |
0.003 |
38 |
10 |
0 |
0.500 |
| 2 |
2 |
|
A |
73 |
20 |
19895 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
74 |
20 |
20081 |
673.5 |
-0.3 |
0.753 |
16 |
0 |
0 |
0.000 |
| 3 |
3 |
|
[HEM]B:750 |
42 |
1 |
814 |
f |
B |
x,y,z |
1_555 |
78 |
24 |
20081 |
524.3 |
-17.9 |
0.305 |
1 |
0 |
0 |
0.314 |
4 |
|
[HEM]A:750 |
42 |
1 |
815 |
f |
A |
x,y,z |
1_555 |
78 |
23 |
19895 |
524.0 |
-18.0 |
0.296 |
1 |
0 |
0 |
0.314 |
| Average: |
524.1 |
-18.0 |
0.301 |
1 |
0 |
0 |
0.314 |
| 4 |
5 |
|
B |
50 |
15 |
20081 |
x |
B |
x-1,y,z |
1_455 |
47 |
15 |
20081 |
460.9 |
2.3 |
0.792 |
6 |
0 |
0 |
0.000 |
| 5 |
6 |
|
B |
40 |
11 |
20081 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
35 |
10 |
19895 |
312.6 |
-1.7 |
0.548 |
3 |
2 |
0 |
0.000 |
| 6 |
7 |
|
[L5Z]B:800 |
25 |
1 |
588 |
f |
B |
x,y,z |
1_555 |
44 |
17 |
20081 |
310.6 |
-1.7 |
0.268 |
1 |
0 |
0 |
0.037 |
8 |
|
[L5Z]A:800 |
25 |
1 |
583 |
f |
A |
x,y,z |
1_555 |
45 |
18 |
19895 |
306.7 |
-2.1 |
0.249 |
0 |
0 |
0 |
0.037 |
| Average: |
308.6 |
-1.9 |
0.258 |
1 |
0 |
0 |
0.037 |
| 7 |
9 |
|
A |
24 |
9 |
19895 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
24 |
8 |
20081 |
204.1 |
1.2 |
0.764 |
0 |
6 |
0 |
0.000 |
| 8 |
10 |
|
[H4B]A:760 |
17 |
1 |
396 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
19895 |
192.8 |
1.8 |
0.433 |
2 |
0 |
0 |
0.000 |
11 |
|
[H4B]B:760 |
17 |
1 |
398 |
f |
B |
x,y,z |
1_555 |
26 |
8 |
20081 |
192.5 |
1.8 |
0.433 |
2 |
0 |
0 |
0.000 |
| Average: |
192.7 |
1.8 |
0.433 |
2 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[L5Z]B:800 |
14 |
1 |
588 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
26 |
1 |
814 |
135.6 |
-4.6 |
0.489 |
2 |
0 |
0 |
0.089 |
13 |
|
[L5Z]A:800 |
15 |
1 |
583 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
26 |
1 |
815 |
132.9 |
-4.5 |
0.508 |
1 |
0 |
0 |
0.089 |
| Average: |
134.2 |
-4.5 |
0.498 |
2 |
0 |
0 |
0.089 |
| 10 |
14 |
|
[H4B]B:760 |
13 |
1 |
398 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
19895 |
117.2 |
-0.1 |
0.253 |
1 |
0 |
0 |
0.010 |
15 |
|
[H4B]A:760 |
13 |
1 |
396 |
◊ |
B |
x,y,z |
1_555 |
21 |
6 |
20081 |
115.0 |
-0.1 |
0.262 |
1 |
0 |
0 |
0.010 |
| Average: |
116.1 |
-0.1 |
0.257 |
1 |
0 |
0 |
0.010 |
| 11 |
16 |
|
[ACT]B:860 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
20081 |
115.9 |
-1.3 |
0.499 |
1 |
0 |
0 |
0.015 |
| 12 |
17 |
|
[ACT]A:860 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
19895 |
113.1 |
-1.3 |
0.507 |
1 |
0 |
0 |
0.015 |
| 13 |
18 |
|
[L5Z]A:800 |
5 |
1 |
583 |
◊ |
B |
x,y,z |
1_555 |
6 |
1 |
20081 |
42.6 |
0.7 |
0.432 |
0 |
0 |
0 |
0.000 |
19 |
|
[L5Z]B:800 |
3 |
1 |
588 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
19895 |
39.8 |
0.7 |
0.480 |
0 |
0 |
0 |
0.000 |
| Average: |
41.2 |
0.7 |
0.456 |
0 |
0 |
0 |
0.000 |
| 14 |
20 |
|
[H4B]A:760 |
5 |
1 |
396 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
815 |
42.3 |
-1.3 |
0.416 |
2 |
0 |
0 |
0.037 |
21 |
|
[H4B]B:760 |
5 |
1 |
398 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
814 |
42.2 |
-1.3 |
0.419 |
2 |
0 |
0 |
0.037 |
| Average: |
42.3 |
-1.3 |
0.418 |
2 |
0 |
0 |
0.037 |
| 15 |
22 |
|
[ZN]A:1717 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
19895 |
34.7 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.257 |
23 |
|
[ZN]A:1717 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20081 |
34.5 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.257 |
| Average: |
34.6 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.257 |
| 16 |
24 |
|
[ACT]A:860 |
3 |
1 |
184 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
815 |
32.0 |
-0.9 |
0.811 |
0 |
0 |
0 |
0.008 |
| 17 |
25 |
|
[ACT]B:860 |
3 |
1 |
182 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
814 |
32.0 |
-0.9 |
0.812 |
0 |
0 |
0 |
0.008 |
| 18 |
26 |
|
B |
3 |
2 |
20081 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
4 |
3 |
20081 |
28.5 |
1.3 |
0.876 |
0 |
0 |
0 |
0.000 |
| 19 |
27 |
|
A |
5 |
3 |
19895 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
20081 |
20.2 |
0.0 |
0.541 |
0 |
0 |
0 |
0.000 |
| 20 |
28 |
|
[L5Z]A:800 |
5 |
1 |
583 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
2 |
1 |
396 |
15.0 |
0.2 |
0.341 |
0 |
0 |
0 |
0.000 |
29 |
|
[L5Z]B:800 |
5 |
1 |
588 |
f |
[H4B]B:760 |
x,y,z |
1_555 |
3 |
1 |
398 |
14.4 |
0.2 |
0.289 |
0 |
0 |
0 |
0.000 |
| Average: |
14.7 |
0.2 |
0.315 |
0 |
0 |
0 |
0.000 |
| 21 |
30 |
|
A |
2 |
1 |
19895 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
19895 |
9.0 |
-0.3 |
0.308 |
0 |
0 |
0 |
0.000 |
| 22 |
31 |
|
A |
2 |
1 |
19895 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
19895 |
3.7 |
-0.5 |
0.153 |
0 |
0 |
0 |
0.000 |
|