## |
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 |
86 |
22 |
7838 |
◊ |
A |
x,y,z |
1_555 |
83 |
23 |
7689 |
836.7 |
-9.9 |
0.317 |
8 |
0 |
0 |
0.259 |
2 |
|
D |
87 |
22 |
7840 |
◊ |
C |
x,y,z |
1_555 |
88 |
22 |
7751 |
820.6 |
-11.1 |
0.282 |
7 |
0 |
0 |
0.259 |
Average: |
828.7 |
-10.5 |
0.300 |
8 |
0 |
0 |
0.259 |
2 |
3 |
|
D |
84 |
20 |
7840 |
◊ |
A |
x,y,z |
1_555 |
65 |
16 |
7689 |
680.4 |
-5.4 |
0.582 |
8 |
3 |
0 |
0.140 |
4 |
|
B |
82 |
19 |
7838 |
◊ |
C |
x,y,z |
1_555 |
69 |
17 |
7751 |
673.7 |
-5.8 |
0.572 |
5 |
0 |
0 |
0.140 |
Average: |
677.1 |
-5.6 |
0.577 |
7 |
2 |
0 |
0.140 |
3 |
5 |
|
[HEM]A:142 |
43 |
1 |
837 |
f |
A |
x,y,z |
1_555 |
72 |
28 |
7689 |
583.1 |
-19.7 |
0.427 |
1 |
0 |
0 |
0.379 |
6 |
|
[HEM]C:142 |
42 |
1 |
835 |
f |
C |
x,y,z |
1_555 |
68 |
27 |
7751 |
579.0 |
-19.7 |
0.409 |
2 |
0 |
0 |
0.379 |
Average: |
581.0 |
-19.7 |
0.418 |
2 |
0 |
0 |
0.379 |
4 |
7 |
|
[HEM]B:147 |
43 |
1 |
821 |
f |
B |
x,y,z |
1_555 |
67 |
23 |
7838 |
559.6 |
-19.0 |
0.291 |
0 |
0 |
0 |
0.356 |
8 |
|
[HEM]D:147 |
43 |
1 |
817 |
f |
D |
x,y,z |
1_555 |
65 |
25 |
7840 |
558.7 |
-18.4 |
0.343 |
0 |
0 |
0 |
0.356 |
Average: |
559.1 |
-18.7 |
0.317 |
0 |
0 |
0 |
0.356 |
5 |
9 |
|
C |
27 |
7 |
7751 |
◊ |
A |
x,y,z |
1_555 |
28 |
8 |
7689 |
273.4 |
4.1 |
0.965 |
5 |
4 |
0 |
0.000 |
6 |
10 |
|
A |
29 |
10 |
7689 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
28 |
9 |
7838 |
269.1 |
-2.7 |
0.476 |
3 |
2 |
0 |
0.000 |
7 |
11 |
|
D |
26 |
9 |
7840 |
◊ |
B |
x,y,z-1 |
1_554 |
27 |
9 |
7838 |
209.4 |
0.2 |
0.721 |
2 |
1 |
0 |
0.000 |
8 |
12 |
|
C |
10 |
5 |
7751 |
◊ |
D |
-x+1/2,y-1/2,-z-1 |
3_544 |
12 |
5 |
7840 |
107.0 |
0.5 |
0.775 |
0 |
1 |
0 |
0.000 |
9 |
13 |
|
A |
11 |
4 |
7689 |
◊ |
[HEM]B:147 |
x-1/2,-y+1/2,-z |
4_455 |
6 |
1 |
821 |
92.3 |
-3.8 |
0.411 |
1 |
0 |
0 |
0.000 |
10 |
14 |
|
C |
9 |
3 |
7751 |
◊ |
B |
-x+1/2,y-1/2,-z |
3_545 |
8 |
3 |
7838 |
84.9 |
0.0 |
0.544 |
0 |
0 |
0 |
0.000 |
11 |
15 |
|
B |
11 |
3 |
7838 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
9 |
3 |
7689 |
84.2 |
-0.6 |
0.579 |
1 |
2 |
0 |
0.000 |
12 |
16 |
|
[HEM]C:142 |
7 |
1 |
835 |
◊ |
B |
-x+1/2,y-1/2,-z |
3_545 |
7 |
3 |
7838 |
67.0 |
-1.7 |
0.712 |
2 |
0 |
0 |
0.000 |
13 |
17 |
|
A |
5 |
2 |
7689 |
◊ |
A |
-x,-y+1,z |
2_565 |
5 |
2 |
7689 |
55.7 |
1.8 |
0.928 |
2 |
2 |
0 |
0.000 |
14 |
18 |
|
[OXY]D:150 |
2 |
1 |
118 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
7840 |
54.5 |
0.3 |
0.761 |
2 |
0 |
0 |
0.010 |
15 |
19 |
|
[OXY]A:150 |
2 |
1 |
119 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
7689 |
53.8 |
0.3 |
0.730 |
1 |
0 |
0 |
0.003 |
16 |
20 |
|
[OXY]B:150 |
2 |
1 |
119 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
7838 |
53.8 |
0.5 |
0.795 |
1 |
0 |
0 |
0.000 |
17 |
21 |
|
[OXY]C:150 |
2 |
1 |
118 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
7751 |
53.3 |
0.4 |
0.793 |
2 |
0 |
0 |
0.009 |
18 |
22 |
|
C |
4 |
2 |
7751 |
◊ |
D |
x-1/2,-y+1/2,-z-1 |
4_454 |
8 |
3 |
7840 |
49.4 |
-0.6 |
0.336 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
D |
4 |
2 |
7840 |
x |
D |
x-1/2,-y+1/2,-z-1 |
4_454 |
3 |
2 |
7840 |
42.2 |
-0.6 |
0.404 |
0 |
0 |
0 |
0.000 |
20 |
24 |
|
[OXY]A:150 |
2 |
1 |
119 |
cf |
[HEM]A:142 |
x,y,z |
1_555 |
17 |
1 |
837 |
40.8 |
-0.3 |
1.000 |
0 |
0 |
0 |
0.006 |
21 |
25 |
|
[OXY]C:150 |
2 |
1 |
118 |
cf |
[HEM]C:142 |
x,y,z |
1_555 |
17 |
1 |
835 |
39.9 |
-0.3 |
1.000 |
0 |
0 |
0 |
0.005 |
22 |
26 |
|
[OXY]B:150 |
2 |
1 |
119 |
cf |
[HEM]B:147 |
x,y,z |
1_555 |
17 |
1 |
821 |
39.6 |
-0.3 |
1.000 |
0 |
0 |
0 |
0.005 |
23 |
27 |
|
[OXY]D:150 |
2 |
1 |
118 |
cf |
[HEM]D:147 |
x,y,z |
1_555 |
18 |
1 |
817 |
39.3 |
-0.3 |
1.000 |
0 |
0 |
0 |
0.005 |
24 |
28 |
|
C |
3 |
1 |
7751 |
◊ |
[HEM]D:147 |
-x+1/2,y-1/2,-z-1 |
3_544 |
5 |
1 |
817 |
26.7 |
-1.1 |
0.783 |
0 |
0 |
0 |
0.000 |
25 |
29 |
|
D |
2 |
1 |
7840 |
x |
D |
-x+1/2,y-1/2,-z-1 |
3_544 |
7 |
3 |
7840 |
21.9 |
0.5 |
0.749 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
C |
1 |
1 |
7751 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
1 |
1 |
7689 |
1.8 |
-0.1 |
0.491 |
0 |
0 |
0 |
0.000 |
27 |
31 |
|
[HEM]A:142 |
1 |
1 |
837 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
7840 |
0.5 |
0.0 |
0.874 |
0 |
0 |
0 |
0.000 |
|