## |
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 |
|
[HEM]A:73 |
43 |
1 |
842 |
f |
A |
x,y,z |
1_555 |
63 |
26 |
5687 |
540.1 |
-19.9 |
0.258 |
0 |
0 |
0 |
0.033 |
2 |
|
[HEM]B:73 |
42 |
1 |
812 |
f |
B |
x,y,z |
1_555 |
62 |
25 |
5779 |
516.9 |
-19.3 |
0.275 |
0 |
0 |
0 |
0.033 |
Average: |
528.5 |
-19.6 |
0.266 |
0 |
0 |
0 |
0.033 |
2 |
3 |
|
[HEM]B:74 |
43 |
1 |
830 |
f |
B |
x,y,z |
1_555 |
63 |
20 |
5779 |
485.7 |
-19.4 |
0.389 |
2 |
0 |
0 |
0.032 |
4 |
|
[HEM]A:74 |
43 |
1 |
837 |
f |
A |
x,y,z |
1_555 |
65 |
20 |
5687 |
478.5 |
-18.2 |
0.464 |
3 |
0 |
0 |
0.032 |
Average: |
482.1 |
-18.8 |
0.427 |
3 |
0 |
0 |
0.032 |
3 |
5 |
|
[HEM]B:72 |
43 |
1 |
835 |
f |
B |
x,y,z |
1_555 |
65 |
22 |
5779 |
476.9 |
-18.3 |
0.463 |
1 |
0 |
0 |
0.030 |
6 |
|
[HEM]A:72 |
43 |
1 |
838 |
f |
A |
x,y,z |
1_555 |
67 |
21 |
5687 |
458.8 |
-17.2 |
0.469 |
1 |
0 |
0 |
0.030 |
Average: |
467.8 |
-17.8 |
0.466 |
1 |
0 |
0 |
0.030 |
4 |
7 |
|
A |
38 |
14 |
5687 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
35 |
14 |
5779 |
339.0 |
-1.3 |
0.689 |
4 |
1 |
0 |
0.000 |
5 |
8 |
|
B |
36 |
10 |
5779 |
x |
B |
x-1,y,z |
1_455 |
35 |
11 |
5779 |
298.0 |
-3.0 |
0.557 |
3 |
0 |
0 |
0.000 |
9 |
|
A |
31 |
8 |
5687 |
x |
A |
x-1,y,z |
1_455 |
31 |
9 |
5687 |
270.3 |
-0.7 |
0.660 |
2 |
0 |
0 |
0.000 |
Average: |
284.1 |
-1.9 |
0.609 |
3 |
0 |
0 |
0.000 |
6 |
10 |
|
A |
31 |
8 |
5687 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
30 |
6 |
5779 |
279.2 |
-1.3 |
0.646 |
1 |
0 |
0 |
0.000 |
7 |
11 |
|
B |
24 |
9 |
5779 |
◊ |
A |
x,y,z |
1_555 |
30 |
11 |
5687 |
221.9 |
2.4 |
0.872 |
3 |
2 |
0 |
0.000 |
8 |
12 |
|
A |
22 |
5 |
5687 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
22 |
8 |
5687 |
213.5 |
-0.5 |
0.623 |
2 |
2 |
0 |
0.000 |
9 |
13 |
|
[HEM]B:72 |
19 |
1 |
835 |
◊ |
[HEM]B:74 |
x-1,y,z |
1_455 |
13 |
1 |
830 |
111.3 |
-3.9 |
0.994 |
0 |
0 |
0 |
0.000 |
14 |
|
[HEM]A:74 |
15 |
1 |
837 |
◊ |
[HEM]A:72 |
x-1,y,z |
1_455 |
19 |
1 |
838 |
106.4 |
-3.7 |
0.998 |
0 |
0 |
0 |
0.000 |
Average: |
108.9 |
-3.8 |
0.996 |
0 |
0 |
0 |
0.000 |
10 |
15 |
|
A |
13 |
7 |
5687 |
◊ |
[HEM]A:72 |
x-1,y,z |
1_455 |
11 |
1 |
838 |
96.7 |
-1.3 |
0.867 |
0 |
0 |
0 |
0.000 |
16 |
|
[HEM]B:72 |
10 |
1 |
835 |
◊ |
B |
x-1,y,z |
1_455 |
12 |
6 |
5779 |
94.8 |
-2.0 |
0.777 |
0 |
0 |
0 |
0.000 |
Average: |
95.8 |
-1.6 |
0.822 |
0 |
0 |
0 |
0.000 |
11 |
17 |
|
[HEM]A:73 |
9 |
1 |
842 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
5779 |
90.2 |
-3.5 |
0.641 |
1 |
0 |
0 |
0.000 |
12 |
18 |
|
[HEM]B:73 |
8 |
1 |
812 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
5687 |
87.3 |
-3.0 |
0.614 |
2 |
0 |
0 |
0.000 |
13 |
19 |
|
A |
11 |
4 |
5687 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
1 |
5779 |
78.6 |
0.4 |
0.738 |
2 |
2 |
0 |
0.000 |
14 |
20 |
|
[HEM]B:73 |
13 |
1 |
812 |
f |
[HEM]B:72 |
x,y,z |
1_555 |
5 |
1 |
835 |
72.9 |
-2.4 |
0.861 |
0 |
0 |
0 |
0.004 |
21 |
|
[HEM]A:73 |
13 |
1 |
842 |
f |
[HEM]A:72 |
x,y,z |
1_555 |
5 |
1 |
838 |
70.0 |
-2.3 |
0.861 |
0 |
0 |
0 |
0.004 |
Average: |
71.4 |
-2.3 |
0.861 |
0 |
0 |
0 |
0.004 |
15 |
22 |
|
A |
11 |
5 |
5687 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
6 |
2 |
5779 |
57.2 |
0.3 |
0.690 |
0 |
0 |
0 |
0.000 |
16 |
23 |
|
[HEM]B:74 |
4 |
1 |
830 |
f |
[HEM]B:73 |
x,y,z |
1_555 |
11 |
1 |
812 |
54.1 |
-1.7 |
0.864 |
0 |
0 |
0 |
0.003 |
24 |
|
[HEM]A:74 |
4 |
1 |
837 |
f |
[HEM]A:73 |
x,y,z |
1_555 |
10 |
1 |
842 |
52.6 |
-1.7 |
0.857 |
0 |
0 |
0 |
0.003 |
Average: |
53.4 |
-1.7 |
0.860 |
0 |
0 |
0 |
0.003 |
17 |
25 |
|
A |
7 |
2 |
5687 |
◊ |
[HEM]A:72 |
x-1/2,-y+1/2,-z |
4_455 |
5 |
1 |
838 |
53.9 |
-2.1 |
0.510 |
1 |
0 |
0 |
0.000 |
18 |
26 |
|
[HEM]A:74 |
6 |
1 |
837 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
5 |
1 |
5687 |
53.3 |
-2.5 |
0.547 |
1 |
0 |
0 |
0.000 |
19 |
27 |
|
[HEM]A:74 |
6 |
1 |
837 |
◊ |
A |
x-1,y,z |
1_455 |
8 |
3 |
5687 |
51.4 |
-1.4 |
0.662 |
0 |
0 |
0 |
0.000 |
28 |
|
B |
7 |
2 |
5779 |
◊ |
[HEM]B:74 |
x-1,y,z |
1_455 |
3 |
1 |
830 |
47.8 |
-0.7 |
0.670 |
0 |
0 |
0 |
0.000 |
Average: |
49.6 |
-1.0 |
0.666 |
0 |
0 |
0 |
0.000 |
20 |
29 |
|
B |
6 |
4 |
5779 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
1 |
5687 |
40.1 |
0.5 |
0.739 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
A |
4 |
2 |
5687 |
◊ |
[HEM]B:74 |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
1 |
830 |
39.8 |
-1.1 |
0.630 |
1 |
0 |
0 |
0.000 |
22 |
31 |
|
B |
2 |
1 |
5779 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
3 |
5687 |
24.8 |
1.1 |
0.848 |
0 |
0 |
0 |
0.000 |
23 |
32 |
|
[HEM]A:74 |
4 |
1 |
837 |
◊ |
[HEM]A:72 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
838 |
17.5 |
-1.7 |
0.729 |
0 |
0 |
0 |
0.000 |
24 |
33 |
|
A |
3 |
1 |
5687 |
◊ |
[HEM]B:72 |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
835 |
14.5 |
-0.5 |
0.597 |
0 |
0 |
0 |
0.000 |
25 |
34 |
|
A |
2 |
1 |
5687 |
◊ |
[HEM]A:74 |
x-1/2,-y+1/2,-z |
4_455 |
3 |
1 |
837 |
11.2 |
-0.7 |
0.552 |
0 |
0 |
0 |
0.000 |
26 |
35 |
|
[HEM]B:73 |
2 |
1 |
812 |
◊ |
[HEM]A:73 |
x,y,z |
1_555 |
1 |
1 |
842 |
9.6 |
-0.8 |
0.438 |
0 |
0 |
0 |
0.000 |
27 |
36 |
|
B |
1 |
1 |
5779 |
x |
B |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
5779 |
2.6 |
-0.1 |
0.518 |
0 |
0 |
0 |
0.000 |
|