| ## |
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 |
84 |
21 |
7670 |
◊ |
A |
x,y,z |
1_555 |
94 |
25 |
7786 |
886.4 |
-9.2 |
0.379 |
7 |
0 |
0 |
0.232 |
2 |
|
D |
83 |
22 |
7596 |
◊ |
C |
x,y,z |
1_555 |
93 |
25 |
7537 |
870.1 |
-9.9 |
0.358 |
7 |
0 |
0 |
0.232 |
| Average: |
878.3 |
-9.6 |
0.369 |
7 |
0 |
0 |
0.232 |
| 2 |
3 |
|
[HEM]A:142 |
43 |
1 |
831 |
f |
A |
x,y,z |
1_555 |
71 |
26 |
7786 |
582.7 |
-20.6 |
0.272 |
1 |
0 |
0 |
0.371 |
4 |
|
[HEM]C:142 |
43 |
1 |
828 |
f |
C |
x,y,z |
1_555 |
72 |
26 |
7537 |
579.1 |
-19.0 |
0.433 |
1 |
0 |
0 |
0.371 |
| Average: |
580.9 |
-19.8 |
0.353 |
1 |
0 |
0 |
0.371 |
| 3 |
5 |
|
[HEM]D:147 |
43 |
1 |
836 |
f |
D |
x,y,z |
1_555 |
63 |
24 |
7596 |
551.4 |
-18.8 |
0.247 |
0 |
0 |
0 |
0.335 |
6 |
|
[HEM]B:147 |
41 |
1 |
833 |
f |
B |
x,y,z |
1_555 |
63 |
24 |
7670 |
549.1 |
-18.6 |
0.227 |
0 |
0 |
0 |
0.335 |
| Average: |
550.3 |
-18.7 |
0.237 |
0 |
0 |
0 |
0.335 |
| 4 |
7 |
|
D |
51 |
11 |
7596 |
◊ |
A |
x,y,z |
1_555 |
44 |
12 |
7786 |
410.4 |
-3.9 |
0.519 |
4 |
0 |
0 |
0.092 |
8 |
|
B |
51 |
11 |
7670 |
◊ |
C |
x,y,z |
1_555 |
42 |
12 |
7537 |
406.2 |
-4.7 |
0.403 |
4 |
0 |
0 |
0.092 |
| Average: |
408.3 |
-4.3 |
0.461 |
4 |
0 |
0 |
0.092 |
| 5 |
9 |
|
C |
40 |
14 |
7537 |
◊ |
A |
x,y,z |
1_555 |
39 |
14 |
7786 |
391.3 |
-3.8 |
0.475 |
6 |
0 |
0 |
0.049 |
| 6 |
10 |
|
A |
25 |
5 |
7786 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
23 |
10 |
7537 |
209.7 |
-3.0 |
0.397 |
1 |
0 |
0 |
0.000 |
| 7 |
11 |
|
B |
20 |
8 |
7670 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
18 |
5 |
7670 |
187.7 |
-1.4 |
0.458 |
1 |
1 |
0 |
0.000 |
| 8 |
12 |
|
C |
21 |
5 |
7537 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
25 |
11 |
7786 |
183.9 |
-1.2 |
0.609 |
0 |
0 |
0 |
0.000 |
| 9 |
13 |
|
D |
19 |
5 |
7596 |
◊ |
B |
x,y,z |
1_555 |
19 |
5 |
7670 |
145.5 |
0.3 |
0.763 |
2 |
0 |
0 |
0.004 |
| 10 |
14 |
|
B |
10 |
4 |
7670 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
16 |
5 |
7786 |
118.0 |
0.1 |
0.646 |
1 |
2 |
0 |
0.000 |
| 11 |
15 |
|
B |
11 |
4 |
7670 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
13 |
5 |
7596 |
101.9 |
-0.8 |
0.558 |
1 |
1 |
0 |
0.000 |
| 12 |
16 |
|
A |
14 |
6 |
7786 |
◊ |
D |
-x+1/2,-y+1,z-1/2 |
2_564 |
10 |
3 |
7596 |
99.6 |
0.8 |
0.796 |
2 |
0 |
0 |
0.000 |
| 13 |
17 |
|
C |
11 |
5 |
7537 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
8 |
3 |
7670 |
70.1 |
0.0 |
0.691 |
0 |
0 |
0 |
0.000 |
| 14 |
18 |
|
[CMO]A:143 |
2 |
1 |
136 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
7786 |
64.4 |
-0.1 |
0.794 |
0 |
0 |
0 |
0.001 |
| 15 |
19 |
|
[CMO]C:143 |
2 |
1 |
136 |
f |
C |
x,y,z |
1_555 |
11 |
7 |
7537 |
64.1 |
-0.0 |
0.800 |
0 |
0 |
0 |
0.000 |
| 16 |
20 |
|
[CMO]B:148 |
2 |
1 |
136 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
7670 |
63.2 |
-0.7 |
0.691 |
0 |
0 |
0 |
0.012 |
| 17 |
21 |
|
[CMO]D:148 |
2 |
1 |
136 |
f |
D |
x,y,z |
1_555 |
12 |
7 |
7596 |
62.4 |
-0.8 |
0.687 |
0 |
0 |
0 |
0.014 |
| 18 |
22 |
|
D |
7 |
2 |
7596 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
5 |
3 |
7537 |
52.1 |
0.1 |
0.689 |
0 |
0 |
0 |
0.000 |
| 19 |
23 |
|
[HEM]C:142 |
6 |
1 |
828 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
2 |
7786 |
51.2 |
-3.2 |
0.225 |
0 |
0 |
0 |
0.000 |
| 20 |
24 |
|
[CMO]D:148 |
2 |
1 |
136 |
cf |
[HEM]D:147 |
x,y,z |
1_555 |
15 |
1 |
836 |
44.8 |
-2.1 |
0.500 |
0 |
0 |
0 |
0.038 |
| 21 |
25 |
|
[CMO]A:143 |
2 |
1 |
136 |
cf |
[HEM]A:142 |
x,y,z |
1_555 |
16 |
1 |
831 |
44.5 |
-2.0 |
0.500 |
0 |
0 |
0 |
0.035 |
| 22 |
26 |
|
[CMO]C:143 |
2 |
1 |
136 |
cf |
[HEM]C:142 |
x,y,z |
1_555 |
16 |
1 |
828 |
44.5 |
-2.0 |
0.500 |
0 |
0 |
0 |
0.035 |
| 23 |
27 |
|
[CMO]B:148 |
2 |
1 |
136 |
cf |
[HEM]B:147 |
x,y,z |
1_555 |
16 |
1 |
833 |
43.9 |
-2.0 |
0.500 |
0 |
0 |
0 |
0.036 |
| 24 |
28 |
|
D |
3 |
1 |
7596 |
◊ |
A |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
2 |
7786 |
20.7 |
-0.2 |
0.519 |
0 |
0 |
0 |
0.000 |
| 25 |
29 |
|
D |
1 |
1 |
7596 |
x |
D |
-x-1/2,-y+1,z-1/2 |
2_464 |
2 |
1 |
7596 |
8.9 |
-0.0 |
0.599 |
0 |
0 |
0 |
0.000 |
| 26 |
30 |
|
[HEM]A:142 |
1 |
1 |
831 |
◊ |
C |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
7537 |
4.6 |
-0.3 |
0.423 |
0 |
0 |
0 |
0.000 |
|