| ## |
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 |
81 |
23 |
18817 |
◊ |
F |
x-1,y,z |
1_455 |
80 |
23 |
18598 |
736.7 |
-10.2 |
0.160 |
4 |
0 |
0 |
0.000 |
2 |
|
D |
82 |
23 |
18604 |
◊ |
E |
x,y-1,z |
1_545 |
77 |
22 |
19125 |
714.0 |
-9.9 |
0.127 |
4 |
0 |
0 |
0.000 |
3 |
|
C |
75 |
21 |
18402 |
◊ |
A |
x,y,z |
1_555 |
73 |
22 |
18790 |
687.8 |
-10.3 |
0.097 |
4 |
0 |
0 |
0.000 |
| Average: |
712.8 |
-10.2 |
0.128 |
4 |
0 |
0 |
0.000 |
| 2 |
4 |
|
[HEM]E:501 |
43 |
1 |
827 |
f |
E |
x,y,z |
1_555 |
91 |
34 |
19125 |
601.5 |
-17.8 |
0.703 |
9 |
0 |
0 |
0.121 |
5 |
|
[HEM]F:501 |
43 |
1 |
832 |
f |
F |
x,y,z |
1_555 |
87 |
31 |
18598 |
591.8 |
-18.5 |
0.702 |
9 |
0 |
0 |
0.121 |
6 |
|
[HEM]C:501 |
43 |
1 |
830 |
f |
C |
x,y,z |
1_555 |
86 |
33 |
18402 |
591.7 |
-20.0 |
0.611 |
7 |
0 |
0 |
0.121 |
7 |
|
[HEM]B:501 |
43 |
1 |
828 |
f |
B |
x,y,z |
1_555 |
89 |
33 |
18817 |
587.0 |
-18.3 |
0.647 |
9 |
0 |
0 |
0.121 |
8 |
|
[HEM]D:501 |
43 |
1 |
824 |
f |
D |
x,y,z |
1_555 |
90 |
33 |
18604 |
586.9 |
-18.1 |
0.650 |
8 |
0 |
0 |
0.121 |
9 |
|
[HEM]A:502 |
43 |
1 |
827 |
f |
A |
x,y,z |
1_555 |
81 |
32 |
18790 |
582.8 |
-17.9 |
0.641 |
9 |
0 |
0 |
0.121 |
| Average: |
590.3 |
-18.5 |
0.659 |
9 |
0 |
0 |
0.121 |
| 3 |
10 |
|
D |
45 |
13 |
18604 |
◊ |
F |
x,y-1,z+1 |
1_546 |
45 |
13 |
18598 |
438.6 |
-2.0 |
0.607 |
4 |
0 |
0 |
0.000 |
11 |
|
E |
45 |
13 |
19125 |
◊ |
A |
x,y,z |
1_555 |
47 |
13 |
18790 |
424.9 |
-2.0 |
0.562 |
3 |
0 |
0 |
0.000 |
12 |
|
B |
42 |
13 |
18817 |
◊ |
C |
x-1,y,z-1 |
1_454 |
48 |
13 |
18402 |
424.8 |
-2.2 |
0.566 |
3 |
0 |
0 |
0.000 |
| Average: |
429.5 |
-2.1 |
0.578 |
3 |
0 |
0 |
0.000 |
| 4 |
13 |
|
D |
36 |
12 |
18604 |
◊ |
A |
x,y,z |
1_555 |
37 |
12 |
18790 |
297.0 |
-0.2 |
0.661 |
0 |
1 |
0 |
0.000 |
14 |
|
D |
34 |
12 |
18604 |
◊ |
B |
x,y,z |
1_555 |
36 |
12 |
18817 |
296.2 |
1.2 |
0.802 |
0 |
1 |
0 |
0.000 |
15 |
|
B |
32 |
10 |
18817 |
◊ |
A |
x-1,y,z |
1_455 |
29 |
9 |
18790 |
277.9 |
0.4 |
0.729 |
2 |
2 |
0 |
0.000 |
| Average: |
290.4 |
0.5 |
0.731 |
1 |
1 |
0 |
0.000 |
| 5 |
16 |
|
E |
23 |
6 |
19125 |
◊ |
C |
x-1,y+1,z-1 |
1_464 |
35 |
13 |
18402 |
218.9 |
0.7 |
0.823 |
2 |
0 |
0 |
0.000 |
17 |
|
F |
24 |
9 |
18598 |
◊ |
E |
x,y,z |
1_555 |
20 |
9 |
19125 |
163.4 |
-0.2 |
0.681 |
0 |
0 |
0 |
0.000 |
18 |
|
C |
19 |
9 |
18402 |
◊ |
F |
x,y-1,z+1 |
1_546 |
20 |
12 |
18598 |
114.1 |
-2.1 |
0.401 |
0 |
0 |
0 |
0.000 |
| Average: |
165.5 |
-0.6 |
0.635 |
1 |
0 |
0 |
0.000 |
| 6 |
19 |
|
[SNE]B:502 |
10 |
1 |
315 |
f |
B |
x,y,z |
1_555 |
33 |
13 |
18817 |
188.7 |
4.5 |
0.298 |
0 |
0 |
0 |
0.000 |
20 |
|
[SNE]D:502 |
9 |
1 |
313 |
f |
D |
x,y,z |
1_555 |
32 |
13 |
18604 |
185.6 |
4.8 |
0.306 |
0 |
0 |
0 |
0.000 |
21 |
|
[SNE]F:502 |
10 |
1 |
314 |
f |
F |
x,y,z |
1_555 |
32 |
13 |
18598 |
183.7 |
4.9 |
0.363 |
0 |
0 |
0 |
0.000 |
| Average: |
186.0 |
4.7 |
0.322 |
0 |
0 |
0 |
0.000 |
| 7 |
22 |
|
[SNE]A:501 |
9 |
1 |
314 |
f |
A |
x,y,z |
1_555 |
34 |
13 |
18790 |
185.7 |
4.4 |
0.283 |
0 |
0 |
0 |
0.000 |
| 8 |
23 |
|
[SNE]E:502 |
9 |
1 |
306 |
f |
E |
x,y,z |
1_555 |
30 |
13 |
19125 |
182.8 |
4.8 |
0.333 |
0 |
0 |
0 |
0.000 |
| 9 |
24 |
|
[SNE]C:502 |
10 |
1 |
311 |
f |
C |
x,y,z |
1_555 |
29 |
13 |
18402 |
181.6 |
4.6 |
0.344 |
0 |
0 |
0 |
0.000 |
| 10 |
25 |
|
F |
10 |
2 |
18598 |
◊ |
D |
x-1,y+1,z-1 |
1_464 |
9 |
2 |
18604 |
87.0 |
-2.5 |
0.114 |
0 |
0 |
0 |
0.000 |
26 |
|
E |
8 |
2 |
19125 |
◊ |
A |
x-1,y,z |
1_455 |
10 |
2 |
18790 |
83.3 |
-2.5 |
0.098 |
0 |
0 |
0 |
0.000 |
27 |
|
B |
9 |
2 |
18817 |
◊ |
C |
x,y,z-1 |
1_554 |
12 |
3 |
18402 |
81.8 |
-2.1 |
0.178 |
0 |
0 |
0 |
0.000 |
| Average: |
84.0 |
-2.4 |
0.130 |
0 |
0 |
0 |
0.000 |
| 11 |
28 |
|
[SNE]A:501 |
5 |
1 |
314 |
f |
[HEM]A:502 |
x,y,z |
1_555 |
23 |
1 |
827 |
62.9 |
-0.8 |
0.187 |
0 |
0 |
0 |
0.004 |
| 12 |
29 |
|
[SNE]F:502 |
5 |
1 |
314 |
f |
[HEM]F:501 |
x,y,z |
1_555 |
21 |
1 |
832 |
59.6 |
-1.0 |
0.203 |
0 |
0 |
0 |
0.006 |
30 |
|
[SNE]B:502 |
4 |
1 |
315 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
22 |
1 |
828 |
58.8 |
-0.8 |
0.309 |
0 |
0 |
0 |
0.006 |
31 |
|
[SNE]D:502 |
5 |
1 |
313 |
f |
[HEM]D:501 |
x,y,z |
1_555 |
22 |
1 |
824 |
58.6 |
-1.1 |
0.163 |
0 |
0 |
0 |
0.006 |
| Average: |
59.0 |
-1.0 |
0.225 |
0 |
0 |
0 |
0.006 |
| 13 |
32 |
|
[SNE]C:502 |
4 |
1 |
311 |
f |
[HEM]C:501 |
x,y,z |
1_555 |
21 |
1 |
830 |
58.9 |
-0.8 |
0.309 |
0 |
0 |
0 |
0.004 |
| 14 |
33 |
|
B |
8 |
3 |
18817 |
◊ |
D |
x-1,y,z |
1_455 |
9 |
3 |
18604 |
57.9 |
0.6 |
0.765 |
0 |
0 |
0 |
0.000 |
34 |
|
B |
9 |
4 |
18817 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
18790 |
47.7 |
0.8 |
0.805 |
0 |
0 |
0 |
0.000 |
35 |
|
D |
5 |
2 |
18604 |
◊ |
A |
x-1,y,z |
1_455 |
8 |
4 |
18790 |
46.1 |
0.5 |
0.753 |
1 |
0 |
0 |
0.000 |
| Average: |
50.6 |
0.6 |
0.774 |
0 |
0 |
0 |
0.000 |
| 15 |
36 |
|
[SNE]E:502 |
5 |
1 |
306 |
f |
[HEM]E:501 |
x,y,z |
1_555 |
21 |
1 |
827 |
55.0 |
-1.1 |
0.133 |
0 |
0 |
0 |
0.006 |
| 16 |
37 |
|
C |
7 |
3 |
18402 |
◊ |
E |
x,y-1,z+1 |
1_546 |
7 |
3 |
19125 |
39.2 |
1.2 |
0.876 |
1 |
0 |
0 |
0.000 |
38 |
|
E |
1 |
1 |
19125 |
◊ |
F |
x-1,y,z |
1_455 |
5 |
2 |
18598 |
25.6 |
0.5 |
0.847 |
0 |
0 |
0 |
0.000 |
39 |
|
F |
4 |
2 |
18598 |
◊ |
C |
x-1,y+1,z-1 |
1_464 |
3 |
1 |
18402 |
13.0 |
0.3 |
0.771 |
0 |
0 |
0 |
0.000 |
| Average: |
25.9 |
0.7 |
0.831 |
0 |
0 |
0 |
0.000 |
|