| ## |
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 |
91 |
24 |
8138 |
◊ |
A |
x,y,z |
1_555 |
91 |
22 |
7747 |
875.1 |
-9.9 |
0.290 |
3 |
2 |
0 |
0.219 |
2 |
|
D |
91 |
24 |
8218 |
◊ |
C |
x,y,z |
1_555 |
89 |
23 |
7861 |
859.5 |
-9.6 |
0.292 |
5 |
2 |
0 |
0.219 |
| Average: |
867.3 |
-9.8 |
0.291 |
4 |
2 |
0 |
0.219 |
| 2 |
3 |
|
D |
77 |
19 |
8218 |
◊ |
A |
x,y,z |
1_555 |
72 |
19 |
7747 |
672.5 |
-3.8 |
0.595 |
7 |
0 |
0 |
0.112 |
4 |
|
B |
75 |
18 |
8138 |
◊ |
C |
x,y,z |
1_555 |
64 |
17 |
7861 |
649.6 |
-5.4 |
0.459 |
6 |
0 |
0 |
0.112 |
| Average: |
661.1 |
-4.6 |
0.527 |
7 |
0 |
0 |
0.112 |
| 3 |
5 |
|
[HEM]C:544 |
43 |
1 |
840 |
f |
C |
x,y,z |
1_555 |
74 |
28 |
7861 |
609.4 |
-21.4 |
0.336 |
2 |
0 |
0 |
0.403 |
6 |
|
[HEM]A:144 |
43 |
1 |
845 |
f |
A |
x,y,z |
1_555 |
72 |
29 |
7747 |
595.4 |
-21.5 |
0.265 |
0 |
0 |
0 |
0.403 |
| Average: |
602.4 |
-21.4 |
0.301 |
1 |
0 |
0 |
0.403 |
| 4 |
7 |
|
[HEM]B:347 |
43 |
1 |
844 |
f |
B |
x,y,z |
1_555 |
68 |
28 |
8138 |
584.4 |
-19.8 |
0.259 |
1 |
0 |
0 |
0.369 |
8 |
|
[HEM]D:747 |
43 |
1 |
836 |
f |
D |
x,y,z |
1_555 |
70 |
28 |
8218 |
574.6 |
-18.8 |
0.257 |
0 |
0 |
0 |
0.369 |
| Average: |
579.5 |
-19.3 |
0.258 |
1 |
0 |
0 |
0.369 |
| 5 |
9 |
|
C |
46 |
12 |
7861 |
◊ |
A |
x,y,z |
1_555 |
42 |
12 |
7747 |
522.8 |
-1.2 |
0.687 |
13 |
4 |
0 |
0.057 |
| 6 |
10 |
|
A |
41 |
14 |
7747 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
29 |
10 |
7861 |
327.2 |
-0.4 |
0.696 |
3 |
0 |
0 |
0.000 |
| 7 |
11 |
|
B |
37 |
11 |
8138 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
28 |
8 |
8218 |
311.2 |
-0.1 |
0.641 |
5 |
0 |
0 |
0.000 |
| 8 |
12 |
|
B |
24 |
8 |
8138 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
17 |
7 |
8138 |
212.5 |
-2.2 |
0.329 |
1 |
0 |
0 |
0.000 |
| 9 |
13 |
|
A |
21 |
7 |
7747 |
◊ |
C |
x,y-1,z |
1_545 |
17 |
5 |
7861 |
154.1 |
2.1 |
0.856 |
2 |
0 |
0 |
0.000 |
| 10 |
14 |
|
D |
12 |
5 |
8218 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
16 |
7 |
7861 |
150.0 |
0.6 |
0.742 |
2 |
1 |
0 |
0.000 |
| 11 |
15 |
|
B |
14 |
6 |
8138 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
15 |
4 |
7861 |
105.9 |
0.0 |
0.703 |
0 |
0 |
0 |
0.000 |
| 12 |
16 |
|
A |
15 |
6 |
7747 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
12 |
6 |
7747 |
98.5 |
1.5 |
0.810 |
0 |
1 |
0 |
0.000 |
| 13 |
17 |
|
A |
8 |
3 |
7747 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
14 |
5 |
8138 |
94.7 |
-1.2 |
0.442 |
0 |
0 |
0 |
0.000 |
| 14 |
18 |
|
[ACE]C:400 |
3 |
1 |
170 |
cf |
C |
x,y,z |
1_555 |
14 |
5 |
7861 |
89.4 |
-1.6 |
0.683 |
1 |
0 |
0 |
0.037 |
| 15 |
19 |
|
[ACE]A:0 |
3 |
1 |
171 |
cf |
A |
x,y,z |
1_555 |
16 |
5 |
7747 |
88.5 |
-1.5 |
0.652 |
0 |
0 |
0 |
0.028 |
| 16 |
20 |
|
D |
10 |
4 |
8218 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
9 |
3 |
7861 |
82.3 |
0.8 |
0.777 |
2 |
0 |
0 |
0.000 |
| 17 |
21 |
|
D |
8 |
3 |
8218 |
x |
D |
-x+1,y-1/2,-z |
2_645 |
15 |
6 |
8218 |
73.6 |
0.7 |
0.729 |
0 |
0 |
0 |
0.000 |
| 18 |
22 |
|
D |
7 |
5 |
8218 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
8138 |
72.2 |
2.3 |
0.925 |
2 |
2 |
0 |
0.000 |
| 19 |
23 |
|
[ACE]A:0 |
3 |
1 |
171 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
7861 |
47.2 |
-1.2 |
0.484 |
0 |
0 |
0 |
0.009 |
| 20 |
24 |
|
B |
4 |
3 |
8138 |
◊ |
A |
x-1,y,z |
1_455 |
8 |
4 |
7747 |
45.9 |
0.8 |
0.825 |
1 |
2 |
0 |
0.000 |
| 21 |
25 |
|
[HEM]D:747 |
4 |
1 |
836 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
7 |
1 |
7861 |
45.2 |
-2.0 |
0.521 |
0 |
0 |
0 |
0.000 |
| 22 |
26 |
|
[ACE]C:400 |
3 |
1 |
170 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
7747 |
40.3 |
-0.9 |
0.488 |
0 |
0 |
0 |
0.006 |
| 23 |
27 |
|
[HEM]B:347 |
3 |
1 |
844 |
◊ |
A |
x-1,y,z |
1_455 |
5 |
2 |
7747 |
35.9 |
-1.6 |
0.513 |
0 |
0 |
0 |
0.000 |
| 24 |
28 |
|
B |
5 |
2 |
8138 |
◊ |
D |
x-1,y,z |
1_455 |
3 |
2 |
8218 |
19.1 |
-0.5 |
0.405 |
0 |
0 |
0 |
0.000 |
| 25 |
29 |
|
B |
5 |
3 |
8138 |
◊ |
C |
x,y-1,z |
1_545 |
4 |
2 |
7861 |
16.7 |
-0.4 |
0.506 |
0 |
0 |
0 |
0.000 |
| 26 |
30 |
|
D |
2 |
1 |
8218 |
x |
D |
-x,y-1/2,-z |
2_545 |
2 |
1 |
8218 |
12.0 |
0.3 |
0.807 |
0 |
0 |
0 |
0.000 |
| 27 |
31 |
|
[HEM]A:144 |
1 |
1 |
845 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
8218 |
0.9 |
-0.0 |
0.851 |
0 |
0 |
0 |
0.000 |
|