| ## |
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 |
|
D |
590 |
144 |
30828 |
◊ |
B |
x,y,z |
1_555 |
582 |
141 |
30917 |
5355.3 |
-41.4 |
0.207 |
65 |
36 |
0 |
0.480 |
2 |
|
C |
577 |
143 |
30764 |
◊ |
A |
x,y,z |
1_555 |
581 |
144 |
30868 |
5331.8 |
-41.5 |
0.188 |
69 |
35 |
0 |
0.480 |
| Average: |
5343.5 |
-41.5 |
0.198 |
67 |
36 |
0 |
0.480 |
| 2 |
3 |
|
D |
501 |
116 |
30828 |
◊ |
A |
x,y,z |
1_555 |
505 |
118 |
30868 |
4821.7 |
-48.2 |
0.048 |
65 |
15 |
0 |
0.487 |
4 |
|
C |
512 |
115 |
30764 |
◊ |
B |
x,y,z |
1_555 |
499 |
115 |
30917 |
4815.4 |
-48.6 |
0.052 |
64 |
15 |
0 |
0.487 |
| Average: |
4818.6 |
-48.4 |
0.050 |
65 |
15 |
0 |
0.487 |
| 3 |
5 |
|
B |
208 |
59 |
30917 |
◊ |
A |
x,y,z |
1_555 |
206 |
59 |
30868 |
1863.4 |
-24.5 |
0.029 |
22 |
0 |
0 |
0.276 |
6 |
|
D |
200 |
58 |
30828 |
◊ |
C |
x,y,z |
1_555 |
201 |
58 |
30764 |
1858.5 |
-24.3 |
0.029 |
23 |
0 |
0 |
0.276 |
| Average: |
1861.0 |
-24.4 |
0.029 |
23 |
0 |
0 |
0.276 |
| 4 |
7 |
|
A |
76 |
25 |
30868 |
◊ |
A |
-x,y,-z+1 |
2_556 |
76 |
25 |
30868 |
668.9 |
4.9 |
0.965 |
2 |
2 |
0 |
0.000 |
| 5 |
8 |
|
B |
73 |
23 |
30917 |
◊ |
B |
-x,y,-z |
2_555 |
73 |
24 |
30917 |
639.8 |
1.9 |
0.901 |
2 |
0 |
0 |
0.000 |
| 6 |
9 |
|
[HEM]D:703 |
43 |
1 |
818 |
f |
D |
x,y,z |
1_555 |
96 |
29 |
30828 |
576.5 |
-18.1 |
0.645 |
5 |
0 |
0 |
0.307 |
10 |
|
[HEM]B:703 |
43 |
1 |
818 |
f |
B |
x,y,z |
1_555 |
93 |
29 |
30917 |
575.7 |
-16.5 |
0.703 |
5 |
0 |
0 |
0.307 |
11 |
|
[HEM]A:704 |
43 |
1 |
813 |
f |
A |
x,y,z |
1_555 |
92 |
29 |
30868 |
573.7 |
-18.0 |
0.629 |
4 |
0 |
0 |
0.307 |
12 |
|
[HEM]C:703 |
43 |
1 |
808 |
f |
C |
x,y,z |
1_555 |
93 |
29 |
30764 |
569.1 |
-16.4 |
0.704 |
4 |
0 |
0 |
0.307 |
| Average: |
573.7 |
-17.3 |
0.670 |
5 |
0 |
0 |
0.307 |
| 7 |
13 |
|
D |
41 |
16 |
30828 |
◊ |
A |
-x-1/2,y-1/2,-z+1/2 |
4_445 |
41 |
16 |
30868 |
313.2 |
1.2 |
0.788 |
3 |
0 |
0 |
0.000 |
| 8 |
14 |
|
C |
32 |
11 |
30764 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
4_545 |
29 |
11 |
30917 |
292.5 |
3.3 |
0.897 |
2 |
0 |
0 |
0.000 |
| 9 |
15 |
|
D |
28 |
10 |
30828 |
◊ |
D |
-x-1,y,-z |
2_455 |
27 |
10 |
30828 |
271.1 |
1.8 |
0.872 |
12 |
4 |
0 |
0.000 |
| 10 |
16 |
|
C |
27 |
9 |
30764 |
◊ |
C |
-x+1,y,-z+1 |
2_656 |
26 |
9 |
30764 |
269.8 |
1.8 |
0.880 |
12 |
4 |
0 |
0.000 |
| 11 |
17 |
|
D |
22 |
7 |
30828 |
◊ |
A |
x-1/2,y-1/2,z-1/2 |
3_444 |
16 |
6 |
30868 |
187.7 |
1.1 |
0.820 |
5 |
0 |
0 |
0.000 |
| 12 |
18 |
|
B |
16 |
4 |
30917 |
◊ |
C |
x-1/2,y+1/2,z-1/2 |
3_454 |
8 |
4 |
30764 |
111.2 |
-1.1 |
0.423 |
0 |
0 |
0 |
0.000 |
| 13 |
19 |
|
[HEM]B:703 |
8 |
1 |
818 |
◊ |
D |
x,y,z |
1_555 |
12 |
4 |
30828 |
80.3 |
-2.2 |
0.493 |
0 |
0 |
0 |
0.028 |
20 |
|
[HEM]D:703 |
8 |
1 |
818 |
◊ |
B |
x,y,z |
1_555 |
11 |
4 |
30917 |
80.3 |
-2.3 |
0.470 |
0 |
0 |
0 |
0.028 |
21 |
|
[HEM]C:703 |
8 |
1 |
808 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
30868 |
80.0 |
-2.2 |
0.468 |
0 |
0 |
0 |
0.028 |
22 |
|
[HEM]A:704 |
7 |
1 |
813 |
◊ |
C |
x,y,z |
1_555 |
12 |
4 |
30764 |
79.3 |
-2.2 |
0.482 |
0 |
0 |
0 |
0.028 |
| Average: |
80.0 |
-2.2 |
0.478 |
0 |
0 |
0 |
0.028 |
| 14 |
23 |
|
[CA]B:702 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
13 |
8 |
30917 |
62.6 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.202 |
24 |
|
[CA]D:702 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
14 |
8 |
30828 |
62.5 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.202 |
25 |
|
[CA]C:702 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
12 |
8 |
30764 |
61.3 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.202 |
| Average: |
62.1 |
-12.6 |
0.000 |
0 |
0 |
0 |
0.202 |
| 15 |
26 |
|
D |
5 |
1 |
30828 |
◊ |
A |
-x,y,-z+1 |
2_556 |
6 |
2 |
30868 |
59.6 |
1.7 |
0.908 |
2 |
4 |
0 |
0.000 |
27 |
|
C |
1 |
1 |
30764 |
◊ |
B |
-x,y,-z |
2_555 |
1 |
1 |
30917 |
3.4 |
0.1 |
0.570 |
0 |
0 |
0 |
0.000 |
| Average: |
31.5 |
0.9 |
0.739 |
1 |
2 |
0 |
0.000 |
| 16 |
28 |
|
[CA]D:701 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
30828 |
49.7 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.183 |
29 |
|
[CA]A:701 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
30868 |
49.0 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.183 |
30 |
|
[CA]C:701 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
30764 |
48.9 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.183 |
31 |
|
[CA]B:701 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
30917 |
48.5 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.183 |
| Average: |
49.0 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.183 |
| 17 |
32 |
|
D |
7 |
3 |
30828 |
x |
D |
-x-1/2,y-1/2,-z+1/2 |
4_445 |
3 |
1 |
30828 |
35.1 |
-0.1 |
0.589 |
0 |
0 |
0 |
0.000 |
| 18 |
33 |
|
[CA]A:702 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
30917 |
29.4 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.078 |
34 |
|
[CA]A:703 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
30868 |
29.3 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.078 |
| Average: |
29.3 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.078 |
| 19 |
35 |
|
[CA]A:702 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
30868 |
29.1 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.086 |
36 |
|
[CA]A:703 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
30917 |
28.9 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.086 |
| Average: |
29.0 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.086 |
| 20 |
37 |
|
D |
3 |
2 |
30828 |
◊ |
B |
-x-1/2,y-1/2,-z+1/2 |
4_445 |
4 |
2 |
30917 |
27.0 |
0.0 |
0.506 |
0 |
0 |
0 |
0.000 |
38 |
|
C |
1 |
1 |
30764 |
◊ |
A |
-x+1/2,y-1/2,-z+1/2 |
4_545 |
1 |
1 |
30868 |
2.5 |
0.1 |
0.779 |
0 |
0 |
0 |
0.000 |
| Average: |
14.8 |
0.1 |
0.643 |
0 |
0 |
0 |
0.000 |
| 21 |
39 |
|
C |
3 |
2 |
30764 |
x |
C |
-x+1/2,y-1/2,-z+1/2 |
4_545 |
1 |
1 |
30764 |
25.8 |
-0.0 |
0.473 |
0 |
0 |
0 |
0.000 |
| 22 |
40 |
|
B |
5 |
2 |
30917 |
◊ |
A |
x-1/2,y-1/2,z-1/2 |
3_444 |
2 |
2 |
30868 |
21.8 |
0.5 |
0.830 |
0 |
0 |
0 |
0.000 |
| 23 |
41 |
|
[CA]A:705 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
30828 |
15.0 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.016 |
42 |
|
[CA]A:705 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
30764 |
14.9 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.016 |
43 |
|
[CA]A:705 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
30917 |
14.4 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.016 |
44 |
|
[CA]A:705 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
30868 |
13.6 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.016 |
| Average: |
14.5 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.016 |
| 24 |
45 |
|
[CA]B:701 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
30868 |
13.2 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.033 |
46 |
|
[CA]C:701 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
30828 |
12.3 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.033 |
47 |
|
[CA]D:701 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
30764 |
12.2 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.033 |
48 |
|
[CA]A:701 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
30917 |
11.7 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.033 |
| Average: |
12.4 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.033 |
| 25 |
49 |
|
[CA]A:703 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
2 |
2 |
30764 |
11.3 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.012 |
50 |
|
[CA]A:702 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
2 |
2 |
30828 |
11.0 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.012 |
| Average: |
11.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.012 |
|