## |
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 |
93 |
25 |
7887 |
◊ |
C |
x,y,z |
1_555 |
95 |
24 |
7786 |
891.7 |
-9.4 |
0.455 |
8 |
1 |
0 |
0.242 |
2 |
|
B |
85 |
23 |
7948 |
◊ |
A |
x,y,z |
1_555 |
93 |
25 |
7761 |
861.2 |
-8.4 |
0.465 |
10 |
1 |
0 |
0.242 |
Average: |
876.5 |
-8.9 |
0.460 |
9 |
1 |
0 |
0.242 |
2 |
3 |
|
[HEM]A:142 |
43 |
1 |
843 |
f |
A |
x,y,z |
1_555 |
72 |
26 |
7761 |
574.8 |
-20.2 |
0.325 |
1 |
0 |
0 |
0.367 |
4 |
|
[HEM]C:142 |
43 |
1 |
841 |
f |
C |
x,y,z |
1_555 |
70 |
26 |
7786 |
567.8 |
-18.6 |
0.418 |
0 |
0 |
0 |
0.367 |
Average: |
571.3 |
-19.4 |
0.371 |
1 |
0 |
0 |
0.367 |
3 |
5 |
|
[HEM]B:147 |
42 |
1 |
818 |
f |
B |
x,y,z |
1_555 |
64 |
25 |
7948 |
528.3 |
-17.7 |
0.281 |
0 |
0 |
0 |
0.324 |
6 |
|
[HEM]D:147 |
41 |
1 |
815 |
f |
D |
x,y,z |
1_555 |
62 |
24 |
7887 |
523.7 |
-17.5 |
0.287 |
0 |
0 |
0 |
0.324 |
Average: |
526.0 |
-17.6 |
0.284 |
0 |
0 |
0 |
0.324 |
4 |
7 |
|
B |
54 |
11 |
7948 |
◊ |
C |
x,y,z |
1_555 |
43 |
13 |
7786 |
433.7 |
-2.2 |
0.689 |
5 |
1 |
0 |
0.072 |
8 |
|
D |
55 |
12 |
7887 |
◊ |
A |
x,y,z |
1_555 |
45 |
14 |
7761 |
423.4 |
-3.0 |
0.636 |
3 |
1 |
0 |
0.072 |
Average: |
428.6 |
-2.6 |
0.663 |
4 |
1 |
0 |
0.072 |
5 |
9 |
|
C |
39 |
12 |
7786 |
◊ |
A |
x,y,z |
1_555 |
41 |
12 |
7761 |
396.7 |
-5.0 |
0.381 |
3 |
0 |
0 |
0.051 |
6 |
10 |
|
D |
34 |
14 |
7887 |
◊ |
A |
x,y,z-1 |
1_554 |
37 |
11 |
7761 |
331.9 |
-4.1 |
0.410 |
2 |
1 |
0 |
0.000 |
7 |
11 |
|
C |
30 |
13 |
7786 |
x |
C |
-x+3/2,-y+1,z-1/2 |
2_664 |
31 |
9 |
7786 |
309.8 |
1.3 |
0.816 |
5 |
3 |
0 |
0.000 |
8 |
12 |
|
B |
31 |
10 |
7948 |
x |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
35 |
9 |
7948 |
297.8 |
-0.5 |
0.748 |
2 |
0 |
0 |
0.000 |
9 |
13 |
|
D |
17 |
6 |
7887 |
◊ |
C |
-x+3/2,-y+1,z-1/2 |
2_664 |
24 |
7 |
7786 |
190.4 |
-0.8 |
0.650 |
1 |
1 |
0 |
0.000 |
10 |
14 |
|
D |
16 |
4 |
7887 |
◊ |
B |
x,y,z |
1_555 |
16 |
4 |
7948 |
149.5 |
0.8 |
0.820 |
2 |
0 |
0 |
0.000 |
11 |
15 |
|
A |
17 |
5 |
7761 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
17 |
5 |
7786 |
133.4 |
-1.9 |
0.465 |
1 |
0 |
0 |
0.000 |
12 |
16 |
|
[CMO]D:148 |
2 |
1 |
136 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
7887 |
64.7 |
-0.9 |
0.677 |
0 |
0 |
0 |
0.016 |
13 |
17 |
|
[CMO]C:143 |
2 |
1 |
136 |
f |
C |
x,y,z |
1_555 |
11 |
7 |
7786 |
63.6 |
-0.1 |
0.793 |
0 |
0 |
0 |
0.000 |
14 |
18 |
|
[CMO]A:143 |
2 |
1 |
135 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
7761 |
62.8 |
-0.0 |
0.792 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[CMO]B:148 |
2 |
1 |
136 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
7948 |
62.7 |
-0.8 |
0.667 |
0 |
0 |
0 |
0.015 |
16 |
20 |
|
D |
6 |
4 |
7887 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
6 |
4 |
7948 |
55.1 |
0.8 |
0.834 |
1 |
2 |
0 |
0.000 |
17 |
21 |
|
A |
4 |
3 |
7761 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
6 |
2 |
7887 |
49.7 |
0.2 |
0.706 |
1 |
1 |
0 |
0.000 |
18 |
22 |
|
[CMO]C:143 |
2 |
1 |
136 |
cf |
[HEM]C:142 |
x,y,z |
1_555 |
16 |
1 |
841 |
44.7 |
-2.0 |
0.500 |
0 |
0 |
0 |
0.037 |
19 |
23 |
|
[CMO]D:148 |
2 |
1 |
136 |
cf |
[HEM]D:147 |
x,y,z |
1_555 |
16 |
1 |
815 |
44.6 |
-2.0 |
0.500 |
0 |
0 |
0 |
0.036 |
20 |
24 |
|
[CMO]A:143 |
2 |
1 |
135 |
cf |
[HEM]A:142 |
x,y,z |
1_555 |
16 |
1 |
843 |
43.8 |
-2.0 |
0.500 |
0 |
0 |
0 |
0.071 |
25 |
|
[CMO]B:148 |
2 |
1 |
136 |
cf |
[HEM]B:147 |
x,y,z |
1_555 |
16 |
1 |
818 |
43.6 |
-2.0 |
0.500 |
0 |
0 |
0 |
0.071 |
Average: |
43.7 |
-2.0 |
0.500 |
0 |
0 |
0 |
0.071 |
21 |
26 |
|
C |
1 |
1 |
7786 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
5 |
2 |
7761 |
31.4 |
-0.2 |
0.225 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
D |
6 |
3 |
7887 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
2 |
7948 |
28.2 |
0.6 |
0.799 |
0 |
0 |
0 |
0.000 |
23 |
28 |
|
D |
3 |
1 |
7887 |
◊ |
B |
x,y,z-1 |
1_554 |
4 |
1 |
7948 |
26.4 |
0.5 |
0.797 |
1 |
1 |
0 |
0.000 |
24 |
29 |
|
[HEM]D:147 |
2 |
1 |
815 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
1 |
7786 |
20.9 |
-1.4 |
0.292 |
0 |
0 |
0 |
0.000 |
25 |
30 |
|
D |
2 |
2 |
7887 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
2 |
7786 |
8.3 |
-0.2 |
0.454 |
0 |
0 |
0 |
0.000 |
|