| ## |
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:501 |
43 |
1 |
831 |
f |
A |
x,y,z |
1_555 |
86 |
33 |
17445 |
619.2 |
-24.5 |
0.205 |
4 |
0 |
0 |
0.080 |
2 |
|
[HEM]B:501 |
43 |
1 |
827 |
f |
B |
x,y,z |
1_555 |
87 |
33 |
17127 |
612.1 |
-24.4 |
0.234 |
5 |
0 |
0 |
0.080 |
| Average: |
615.7 |
-24.5 |
0.219 |
5 |
0 |
0 |
0.080 |
| 2 |
3 |
|
C |
62 |
16 |
5458 |
◊ |
A |
x,y,z |
1_555 |
61 |
16 |
17445 |
582.3 |
-3.3 |
0.466 |
8 |
4 |
0 |
0.000 |
4 |
|
D |
61 |
17 |
5495 |
◊ |
B |
x,y,z |
1_555 |
63 |
18 |
17127 |
580.2 |
-3.0 |
0.525 |
7 |
4 |
0 |
0.000 |
| Average: |
581.3 |
-3.2 |
0.496 |
8 |
4 |
0 |
0.000 |
| 3 |
5 |
|
B |
63 |
19 |
17127 |
◊ |
A |
x,y,z |
1_555 |
66 |
20 |
17445 |
573.8 |
-3.6 |
0.387 |
6 |
4 |
0 |
0.000 |
6 |
|
B |
53 |
18 |
17127 |
◊ |
A |
x-1,y,z-1 |
1_454 |
53 |
18 |
17445 |
523.7 |
-2.9 |
0.384 |
4 |
4 |
0 |
0.000 |
| Average: |
548.8 |
-3.2 |
0.385 |
5 |
4 |
0 |
0.000 |
| 4 |
7 |
|
B |
27 |
8 |
17127 |
x |
B |
x-1,y,z |
1_455 |
26 |
7 |
17127 |
263.1 |
-1.8 |
0.438 |
2 |
0 |
0 |
0.000 |
| 5 |
8 |
|
A |
20 |
6 |
17445 |
x |
A |
x-1,y,z |
1_455 |
21 |
7 |
17445 |
201.7 |
1.3 |
0.782 |
6 |
6 |
0 |
0.000 |
| 6 |
9 |
|
C |
24 |
11 |
5458 |
◊ |
A |
-x+1,y-1/2,-z+3 |
2_648 |
24 |
11 |
17445 |
186.0 |
0.3 |
0.678 |
1 |
0 |
0 |
0.000 |
10 |
|
B |
19 |
7 |
17127 |
◊ |
D |
-x,y-1/2,-z+2 |
2_547 |
16 |
8 |
5495 |
122.3 |
0.1 |
0.646 |
1 |
0 |
0 |
0.000 |
| Average: |
154.1 |
0.2 |
0.662 |
1 |
0 |
0 |
0.000 |
| 7 |
11 |
|
A |
22 |
5 |
17445 |
◊ |
D |
-x,y-1/2,-z+3 |
2_548 |
22 |
7 |
5495 |
181.3 |
-0.5 |
0.590 |
1 |
3 |
0 |
0.000 |
| 8 |
12 |
|
B |
21 |
10 |
17127 |
◊ |
A |
x-1,y,z |
1_455 |
26 |
7 |
17445 |
180.1 |
-2.0 |
0.323 |
0 |
0 |
0 |
0.000 |
| 9 |
13 |
|
C |
17 |
6 |
5458 |
◊ |
B |
-x,y-1/2,-z+2 |
2_547 |
14 |
6 |
17127 |
157.4 |
0.5 |
0.624 |
2 |
0 |
0 |
0.000 |
14 |
|
A |
15 |
6 |
17445 |
◊ |
D |
-x,y-1/2,-z+2 |
2_547 |
15 |
5 |
5495 |
142.0 |
0.4 |
0.546 |
1 |
0 |
0 |
0.000 |
| Average: |
149.7 |
0.4 |
0.585 |
2 |
0 |
0 |
0.000 |
| 10 |
15 |
|
A |
14 |
5 |
17445 |
◊ |
D |
-x+1,y-1/2,-z+3 |
2_648 |
20 |
6 |
5495 |
152.5 |
1.0 |
0.747 |
1 |
0 |
0 |
0.000 |
16 |
|
C |
17 |
5 |
5458 |
◊ |
B |
-x+1,y-1/2,-z+3 |
2_648 |
14 |
6 |
17127 |
133.2 |
-0.1 |
0.456 |
2 |
0 |
0 |
0.000 |
| Average: |
142.9 |
0.4 |
0.601 |
2 |
0 |
0 |
0.000 |
| 11 |
17 |
|
A |
15 |
4 |
17445 |
◊ |
B |
-x,y-1/2,-z+2 |
2_547 |
16 |
5 |
17127 |
126.0 |
0.3 |
0.694 |
2 |
0 |
0 |
0.000 |
| 12 |
18 |
|
[FES]C:201 |
4 |
1 |
233 |
f |
C |
x,y,z |
1_555 |
12 |
9 |
5458 |
123.1 |
-16.7 |
0.593 |
1 |
0 |
0 |
0.089 |
| 13 |
19 |
|
[FES]D:201 |
4 |
1 |
235 |
f |
D |
x,y,z |
1_555 |
13 |
10 |
5495 |
122.3 |
-16.7 |
0.627 |
1 |
0 |
0 |
0.100 |
| 14 |
20 |
|
C |
9 |
4 |
5458 |
◊ |
A |
-x+2,y-1/2,-z+3 |
2_748 |
11 |
5 |
17445 |
90.1 |
-0.7 |
0.389 |
0 |
0 |
0 |
0.000 |
| 15 |
21 |
|
[1N0]A:503 |
10 |
1 |
448 |
cf |
C |
x,y,z |
1_555 |
11 |
5 |
5458 |
85.9 |
-2.2 |
0.055 |
0 |
0 |
0 |
0.011 |
| 16 |
22 |
|
[1N0]A:503 |
10 |
1 |
448 |
◊ |
B |
-x+1,y-1/2,-z+3 |
2_648 |
5 |
2 |
17127 |
70.8 |
-2.1 |
0.039 |
0 |
0 |
0 |
0.000 |
| 17 |
23 |
|
[1N0]A:503 |
6 |
1 |
448 |
c |
A |
x,y,z |
1_555 |
4 |
2 |
17445 |
58.4 |
-0.2 |
0.040 |
0 |
0 |
0 |
0.000 |
| 18 |
24 |
|
[CA]A:502 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
17127 |
37.0 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
|
[CA]B:502 |
1 |
1 |
85 |
◊ |
A |
x-1,y,z-1 |
1_454 |
5 |
4 |
17445 |
35.5 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
36.2 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 19 |
26 |
|
[CA]B:502 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
17127 |
34.5 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.021 |
27 |
|
[CA]A:502 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
17445 |
33.8 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.021 |
| Average: |
34.2 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.021 |
| 20 |
28 |
|
B |
3 |
1 |
17127 |
x |
B |
-x,y-1/2,-z+2 |
2_547 |
3 |
1 |
17127 |
29.9 |
1.0 |
0.895 |
0 |
0 |
0 |
0.000 |
| 21 |
29 |
|
[1N0]A:503 |
1 |
1 |
448 |
◊ |
D |
-x+1,y-1/2,-z+3 |
2_648 |
4 |
2 |
5495 |
13.8 |
-0.1 |
0.441 |
0 |
0 |
0 |
0.000 |
| 22 |
30 |
|
A |
2 |
1 |
17445 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
3 |
5458 |
10.5 |
0.5 |
0.820 |
0 |
0 |
0 |
0.000 |
| 23 |
31 |
|
C |
1 |
1 |
5458 |
◊ |
B |
-x+1,y-1/2,-z+2 |
2_647 |
1 |
1 |
17127 |
1.7 |
0.0 |
0.576 |
0 |
0 |
0 |
0.000 |
|