| ## |
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 |
69 |
20101 |
◊ |
A |
x,y,z |
1_555 |
262 |
67 |
19929 |
2586.6 |
-38.6 |
0.006 |
39 |
9 |
0 |
0.455 |
| 2 |
2 |
|
A |
67 |
20 |
19929 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
70 |
19 |
20101 |
662.5 |
-1.4 |
0.683 |
11 |
0 |
0 |
0.000 |
| 3 |
3 |
|
[HEM]A:750 |
41 |
1 |
827 |
f |
A |
x,y,z |
1_555 |
82 |
25 |
19929 |
524.9 |
-19.0 |
0.270 |
2 |
0 |
0 |
0.312 |
4 |
|
[HEM]B:750 |
42 |
1 |
831 |
f |
B |
x,y,z |
1_555 |
83 |
24 |
20101 |
521.0 |
-18.4 |
0.341 |
2 |
0 |
0 |
0.312 |
| Average: |
523.0 |
-18.7 |
0.305 |
2 |
0 |
0 |
0.312 |
| 4 |
5 |
|
B |
51 |
15 |
20101 |
x |
B |
x-1,y,z |
1_455 |
51 |
15 |
20101 |
488.3 |
-0.1 |
0.664 |
3 |
0 |
0 |
0.000 |
| 5 |
6 |
|
[6M8]A:800 |
24 |
1 |
590 |
f |
A |
x,y,z |
1_555 |
38 |
17 |
19929 |
291.1 |
-3.8 |
0.341 |
3 |
0 |
0 |
0.084 |
7 |
|
[6M8]B:800 |
24 |
1 |
580 |
f |
B |
x,y,z |
1_555 |
38 |
16 |
20101 |
285.3 |
-4.0 |
0.292 |
3 |
0 |
0 |
0.084 |
| Average: |
288.2 |
-3.9 |
0.317 |
3 |
0 |
0 |
0.084 |
| 6 |
8 |
|
B |
37 |
9 |
20101 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
31 |
8 |
19929 |
286.3 |
-2.6 |
0.439 |
3 |
2 |
0 |
0.000 |
| 7 |
9 |
|
[H4B]B:760 |
17 |
1 |
396 |
f |
B |
x,y,z |
1_555 |
31 |
9 |
20101 |
188.3 |
2.1 |
0.513 |
3 |
0 |
0 |
0.000 |
10 |
|
[H4B]A:760 |
17 |
1 |
397 |
f |
A |
x,y,z |
1_555 |
30 |
9 |
19929 |
182.2 |
2.1 |
0.462 |
3 |
0 |
0 |
0.000 |
| Average: |
185.3 |
2.1 |
0.488 |
3 |
0 |
0 |
0.000 |
| 8 |
11 |
|
A |
21 |
9 |
19929 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
22 |
7 |
20101 |
175.3 |
1.2 |
0.756 |
1 |
3 |
0 |
0.000 |
| 9 |
12 |
|
[6M8]B:800 |
19 |
1 |
580 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
34 |
1 |
831 |
162.6 |
-4.3 |
0.812 |
0 |
0 |
0 |
0.069 |
13 |
|
[6M8]A:800 |
18 |
1 |
590 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
31 |
1 |
827 |
162.0 |
-4.4 |
0.798 |
0 |
0 |
0 |
0.069 |
| Average: |
162.3 |
-4.4 |
0.805 |
0 |
0 |
0 |
0.069 |
| 10 |
14 |
|
[H4B]B:760 |
15 |
1 |
396 |
◊ |
A |
x,y,z |
1_555 |
21 |
6 |
19929 |
118.0 |
-0.3 |
0.236 |
1 |
0 |
0 |
0.010 |
15 |
|
[H4B]A:760 |
13 |
1 |
397 |
◊ |
B |
x,y,z |
1_555 |
21 |
6 |
20101 |
116.0 |
-0.1 |
0.254 |
1 |
0 |
0 |
0.010 |
| Average: |
117.0 |
-0.2 |
0.245 |
1 |
0 |
0 |
0.010 |
| 11 |
16 |
|
[ACT]B:860 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
20101 |
112.7 |
-1.3 |
0.504 |
1 |
0 |
0 |
0.014 |
| 12 |
17 |
|
[ACT]A:860 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
19929 |
111.6 |
-1.3 |
0.473 |
2 |
0 |
0 |
0.017 |
| 13 |
18 |
|
[H4B]A:760 |
4 |
1 |
397 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
6 |
1 |
827 |
40.8 |
-0.9 |
0.531 |
1 |
0 |
0 |
0.024 |
19 |
|
[H4B]B:760 |
5 |
1 |
396 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
831 |
38.3 |
-1.2 |
0.433 |
1 |
0 |
0 |
0.024 |
| Average: |
39.5 |
-1.0 |
0.482 |
1 |
0 |
0 |
0.024 |
| 14 |
20 |
|
[ACT]A:860 |
3 |
1 |
183 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
827 |
36.5 |
-1.1 |
0.752 |
0 |
0 |
0 |
0.009 |
| 15 |
21 |
|
[6M8]B:800 |
3 |
1 |
580 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
19929 |
35.6 |
-1.1 |
0.346 |
0 |
0 |
0 |
0.016 |
22 |
|
[6M8]A:800 |
3 |
1 |
590 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
20101 |
31.0 |
-0.9 |
0.299 |
0 |
0 |
0 |
0.016 |
| Average: |
33.3 |
-1.0 |
0.322 |
0 |
0 |
0 |
0.016 |
| 16 |
23 |
|
[6M8]A:800 |
6 |
1 |
590 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
3 |
1 |
397 |
35.0 |
0.4 |
0.278 |
0 |
0 |
0 |
0.000 |
24 |
|
[6M8]B:800 |
3 |
1 |
580 |
f |
[H4B]B:760 |
x,y,z |
1_555 |
3 |
1 |
396 |
30.7 |
0.4 |
0.321 |
0 |
0 |
0 |
0.000 |
| Average: |
32.8 |
0.4 |
0.299 |
0 |
0 |
0 |
0.000 |
| 17 |
25 |
|
[ZN]B:900 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
19929 |
34.6 |
-20.1 |
0.000 |
0 |
0 |
0 |
0.244 |
26 |
|
[ZN]B:900 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20101 |
34.4 |
-20.5 |
0.000 |
0 |
0 |
0 |
0.244 |
| Average: |
34.5 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.244 |
| 18 |
27 |
|
[ACT]B:860 |
3 |
1 |
182 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
831 |
34.4 |
-1.0 |
0.754 |
0 |
0 |
0 |
0.008 |
| 19 |
28 |
|
B |
1 |
1 |
20101 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
2 |
20101 |
18.9 |
1.0 |
0.885 |
0 |
0 |
0 |
0.000 |
| 20 |
29 |
|
A |
2 |
2 |
19929 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
2 |
20101 |
11.4 |
0.1 |
0.687 |
0 |
0 |
0 |
0.000 |
| 21 |
30 |
|
A |
1 |
1 |
19929 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
19929 |
0.3 |
-0.0 |
0.586 |
0 |
0 |
0 |
0.000 |
|