| ## |
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 |
88 |
24 |
8081 |
◊ |
A |
x,y,z |
1_555 |
86 |
23 |
7889 |
867.2 |
-10.1 |
0.315 |
8 |
0 |
0 |
0.250 |
2 |
|
D |
90 |
24 |
8029 |
◊ |
C |
x,y,z |
1_555 |
84 |
23 |
7880 |
826.4 |
-10.0 |
0.313 |
6 |
0 |
0 |
0.250 |
| Average: |
846.8 |
-10.1 |
0.314 |
7 |
0 |
0 |
0.250 |
| 2 |
3 |
|
D |
82 |
19 |
8029 |
◊ |
A |
x,y,z |
1_555 |
64 |
17 |
7889 |
660.5 |
-5.6 |
0.536 |
5 |
0 |
0 |
0.119 |
4 |
|
B |
79 |
18 |
8081 |
◊ |
C |
x,y,z |
1_555 |
64 |
17 |
7880 |
638.6 |
-5.3 |
0.558 |
3 |
0 |
0 |
0.119 |
| Average: |
649.5 |
-5.4 |
0.547 |
4 |
0 |
0 |
0.119 |
| 3 |
5 |
|
[HEM]A:142 |
42 |
1 |
833 |
f |
A |
x,y,z |
1_555 |
72 |
28 |
7889 |
613.2 |
-20.1 |
0.433 |
1 |
0 |
0 |
0.380 |
6 |
|
[HEM]C:142 |
42 |
1 |
839 |
f |
C |
x,y,z |
1_555 |
76 |
28 |
7880 |
595.8 |
-19.3 |
0.566 |
2 |
0 |
0 |
0.380 |
| Average: |
604.5 |
-19.7 |
0.500 |
2 |
0 |
0 |
0.380 |
| 4 |
7 |
|
[HEM]B:147 |
43 |
1 |
816 |
f |
B |
x,y,z |
1_555 |
65 |
23 |
8081 |
572.8 |
-19.4 |
0.267 |
0 |
0 |
0 |
0.376 |
8 |
|
[HEM]D:147 |
42 |
1 |
828 |
f |
D |
x,y,z |
1_555 |
71 |
27 |
8029 |
560.3 |
-19.9 |
0.225 |
0 |
0 |
0 |
0.376 |
| Average: |
566.5 |
-19.7 |
0.246 |
0 |
0 |
0 |
0.376 |
| 5 |
9 |
|
A |
34 |
10 |
7889 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
27 |
10 |
8081 |
286.1 |
-1.9 |
0.597 |
4 |
2 |
0 |
0.000 |
| 6 |
10 |
|
C |
28 |
8 |
7880 |
◊ |
A |
x,y,z |
1_555 |
29 |
8 |
7889 |
271.1 |
3.6 |
0.950 |
5 |
4 |
0 |
0.000 |
| 7 |
11 |
|
D |
28 |
9 |
8029 |
◊ |
B |
x,y,z-1 |
1_554 |
29 |
9 |
8081 |
228.7 |
0.3 |
0.707 |
2 |
0 |
0 |
0.000 |
| 8 |
12 |
|
C |
10 |
5 |
7880 |
◊ |
D |
-x+1/2,y-1/2,-z-1 |
3_544 |
12 |
5 |
8029 |
119.5 |
0.4 |
0.757 |
0 |
2 |
0 |
0.000 |
| 9 |
13 |
|
A |
10 |
3 |
7889 |
◊ |
[HEM]B:147 |
x-1/2,-y+1/2,-z |
4_455 |
6 |
1 |
816 |
89.7 |
-3.5 |
0.440 |
1 |
0 |
0 |
0.000 |
| 10 |
14 |
|
C |
9 |
4 |
7880 |
◊ |
B |
-x+1/2,y-1/2,-z |
3_545 |
9 |
3 |
8081 |
87.0 |
1.2 |
0.786 |
0 |
0 |
0 |
0.000 |
| 11 |
15 |
|
B |
11 |
3 |
8081 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
11 |
6 |
7889 |
82.8 |
-0.1 |
0.632 |
0 |
1 |
0 |
0.000 |
| 12 |
16 |
|
[HEM]C:142 |
8 |
1 |
839 |
◊ |
B |
-x+1/2,y-1/2,-z |
3_545 |
6 |
3 |
8081 |
75.0 |
-1.4 |
0.791 |
1 |
0 |
0 |
0.000 |
| 13 |
17 |
|
C |
5 |
3 |
7880 |
◊ |
D |
x-1/2,-y+1/2,-z-1 |
4_454 |
8 |
4 |
8029 |
56.3 |
-0.6 |
0.344 |
0 |
0 |
0 |
0.000 |
| 14 |
18 |
|
[OXY]B:150 |
2 |
1 |
120 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
8081 |
55.2 |
0.5 |
0.792 |
2 |
0 |
0 |
0.008 |
| 15 |
19 |
|
[OXY]D:150 |
2 |
1 |
121 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
8029 |
55.0 |
0.3 |
0.731 |
0 |
0 |
0 |
0.000 |
| 16 |
20 |
|
[OXY]A:150 |
2 |
1 |
120 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
7889 |
54.7 |
0.2 |
0.712 |
1 |
0 |
0 |
0.004 |
| 17 |
21 |
|
[OXY]C:150 |
2 |
1 |
120 |
f |
C |
x,y,z |
1_555 |
8 |
6 |
7880 |
54.3 |
0.9 |
0.889 |
2 |
0 |
0 |
0.000 |
| 18 |
22 |
|
[OXY]A:150 |
2 |
1 |
120 |
cf |
[HEM]A:142 |
x,y,z |
1_555 |
17 |
1 |
833 |
41.4 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.004 |
| 19 |
23 |
|
[OXY]D:150 |
2 |
1 |
121 |
cf |
[HEM]D:147 |
x,y,z |
1_555 |
17 |
1 |
828 |
41.1 |
-0.4 |
1.000 |
0 |
0 |
0 |
0.008 |
| 20 |
24 |
|
[OXY]B:150 |
2 |
1 |
120 |
cf |
[HEM]B:147 |
x,y,z |
1_555 |
16 |
1 |
816 |
40.4 |
-0.3 |
1.000 |
0 |
0 |
0 |
0.005 |
| 21 |
25 |
|
[OXY]C:150 |
2 |
1 |
120 |
cf |
[HEM]C:142 |
x,y,z |
1_555 |
17 |
1 |
839 |
40.0 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.003 |
| 22 |
26 |
|
D |
4 |
3 |
8029 |
x |
D |
x-1/2,-y+1/2,-z-1 |
4_454 |
4 |
2 |
8029 |
36.6 |
-0.4 |
0.485 |
0 |
0 |
0 |
0.000 |
| 23 |
27 |
|
A |
4 |
2 |
7889 |
◊ |
A |
-x,-y+1,z |
2_565 |
4 |
2 |
7889 |
30.2 |
1.2 |
0.900 |
0 |
0 |
0 |
0.000 |
| 24 |
28 |
|
C |
3 |
1 |
7880 |
◊ |
[HEM]D:147 |
-x+1/2,y-1/2,-z-1 |
3_544 |
4 |
1 |
828 |
26.0 |
-0.6 |
0.798 |
0 |
0 |
0 |
0.000 |
| 25 |
29 |
|
C |
4 |
2 |
7880 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
3 |
2 |
7889 |
20.5 |
-0.3 |
0.545 |
0 |
0 |
0 |
0.000 |
| 26 |
30 |
|
D |
2 |
1 |
8029 |
x |
D |
-x+1/2,y-1/2,-z-1 |
3_544 |
3 |
2 |
8029 |
8.0 |
0.1 |
0.722 |
0 |
0 |
0 |
0.000 |
| 27 |
31 |
|
C |
2 |
1 |
7880 |
◊ |
C |
-x,-y,z |
2_555 |
2 |
1 |
7880 |
5.0 |
-0.1 |
0.561 |
0 |
0 |
0 |
0.000 |
|