## |
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 |
83 |
22 |
8017 |
◊ |
A |
x,y,z |
1_555 |
86 |
23 |
7782 |
831.9 |
-9.2 |
0.394 |
7 |
0 |
0 |
0.231 |
2 |
|
D |
87 |
22 |
7975 |
◊ |
C |
x,y,z |
1_555 |
82 |
21 |
7878 |
819.5 |
-10.2 |
0.338 |
4 |
0 |
0 |
0.231 |
Average: |
825.7 |
-9.7 |
0.366 |
6 |
0 |
0 |
0.231 |
2 |
3 |
|
D |
80 |
19 |
7975 |
◊ |
A |
x,y,z |
1_555 |
65 |
16 |
7782 |
672.4 |
-5.3 |
0.601 |
7 |
1 |
0 |
0.138 |
4 |
|
B |
80 |
19 |
8017 |
◊ |
C |
x,y,z |
1_555 |
69 |
17 |
7878 |
663.2 |
-5.7 |
0.597 |
6 |
0 |
0 |
0.138 |
Average: |
667.8 |
-5.5 |
0.599 |
7 |
1 |
0 |
0.138 |
3 |
5 |
|
[HEM]C:142 |
43 |
1 |
842 |
f |
C |
x,y,z |
1_555 |
73 |
27 |
7878 |
588.6 |
-20.8 |
0.337 |
2 |
0 |
0 |
0.407 |
6 |
|
[HEM]A:142 |
43 |
1 |
840 |
f |
A |
x,y,z |
1_555 |
73 |
27 |
7782 |
587.4 |
-20.4 |
0.371 |
2 |
0 |
0 |
0.407 |
Average: |
588.0 |
-20.6 |
0.354 |
2 |
0 |
0 |
0.407 |
4 |
7 |
|
[HEM]D:147 |
43 |
1 |
830 |
f |
D |
x,y,z |
1_555 |
69 |
26 |
7975 |
566.1 |
-18.9 |
0.360 |
0 |
0 |
0 |
0.359 |
8 |
|
[HEM]B:147 |
43 |
1 |
826 |
f |
B |
x,y,z |
1_555 |
65 |
23 |
8017 |
565.9 |
-19.2 |
0.313 |
0 |
0 |
0 |
0.359 |
Average: |
566.0 |
-19.0 |
0.337 |
0 |
0 |
0 |
0.359 |
5 |
9 |
|
C |
29 |
10 |
7878 |
◊ |
A |
x,y,z |
1_555 |
30 |
10 |
7782 |
275.2 |
4.1 |
0.963 |
6 |
4 |
0 |
0.000 |
6 |
10 |
|
A |
31 |
10 |
7782 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
27 |
9 |
8017 |
271.1 |
-2.6 |
0.513 |
3 |
2 |
0 |
0.000 |
7 |
11 |
|
D |
31 |
9 |
7975 |
◊ |
B |
x,y,z-1 |
1_554 |
28 |
9 |
8017 |
237.0 |
-0.2 |
0.729 |
3 |
1 |
0 |
0.000 |
8 |
12 |
|
C |
10 |
5 |
7878 |
◊ |
D |
-x+1/2,y-1/2,-z-1 |
3_544 |
11 |
4 |
7975 |
110.0 |
0.0 |
0.708 |
0 |
2 |
0 |
0.000 |
9 |
13 |
|
C |
15 |
6 |
7878 |
◊ |
B |
-x+1/2,y-1/2,-z |
3_545 |
11 |
4 |
8017 |
108.2 |
1.3 |
0.851 |
0 |
0 |
0 |
0.000 |
10 |
14 |
|
A |
12 |
4 |
7782 |
◊ |
[HEM]B:147 |
x-1/2,-y+1/2,-z |
4_455 |
6 |
1 |
826 |
90.1 |
-3.7 |
0.431 |
1 |
0 |
0 |
0.000 |
11 |
15 |
|
[HEM]C:142 |
6 |
1 |
842 |
◊ |
B |
-x+1/2,y-1/2,-z |
3_545 |
8 |
3 |
8017 |
79.0 |
-3.2 |
0.457 |
1 |
0 |
0 |
0.000 |
12 |
16 |
|
B |
11 |
3 |
8017 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
8 |
3 |
7782 |
76.8 |
-0.1 |
0.666 |
0 |
2 |
0 |
0.000 |
13 |
17 |
|
[OXY]C:150 |
2 |
1 |
120 |
f |
C |
x,y,z |
1_555 |
8 |
6 |
7878 |
55.2 |
0.1 |
0.669 |
1 |
0 |
0 |
0.006 |
14 |
18 |
|
[OXY]A:150 |
2 |
1 |
119 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
7782 |
54.5 |
0.2 |
0.698 |
1 |
0 |
0 |
0.005 |
15 |
19 |
|
[OXY]D:150 |
2 |
1 |
120 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
7975 |
54.0 |
1.0 |
0.905 |
2 |
0 |
0 |
0.000 |
16 |
20 |
|
[OXY]B:150 |
2 |
1 |
120 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
8017 |
52.7 |
0.5 |
0.817 |
1 |
0 |
0 |
0.000 |
17 |
21 |
|
C |
4 |
2 |
7878 |
◊ |
D |
x-1/2,-y+1/2,-z-1 |
4_454 |
6 |
3 |
7975 |
45.2 |
-0.4 |
0.375 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
A |
5 |
2 |
7782 |
◊ |
A |
-x,-y+1,z |
2_565 |
5 |
2 |
7782 |
45.1 |
0.5 |
0.812 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[OXY]B:150 |
2 |
1 |
120 |
cf |
[HEM]B:147 |
x,y,z |
1_555 |
17 |
1 |
826 |
41.3 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.003 |
20 |
24 |
|
[OXY]A:150 |
2 |
1 |
119 |
cf |
[HEM]A:142 |
x,y,z |
1_555 |
16 |
1 |
840 |
41.2 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.004 |
21 |
25 |
|
[OXY]D:150 |
2 |
1 |
120 |
cf |
[HEM]D:147 |
x,y,z |
1_555 |
18 |
1 |
830 |
41.2 |
-0.2 |
1.000 |
0 |
0 |
0 |
0.004 |
22 |
26 |
|
[OXY]C:150 |
2 |
1 |
120 |
cf |
[HEM]C:142 |
x,y,z |
1_555 |
16 |
1 |
842 |
40.8 |
-0.3 |
1.000 |
0 |
0 |
0 |
0.006 |
23 |
27 |
|
C |
3 |
1 |
7878 |
◊ |
[HEM]D:147 |
-x+1/2,y-1/2,-z-1 |
3_544 |
4 |
1 |
830 |
32.0 |
-0.7 |
0.715 |
1 |
0 |
0 |
0.000 |
24 |
28 |
|
D |
3 |
1 |
7975 |
x |
D |
-x+1/2,y-1/2,-z-1 |
3_544 |
7 |
2 |
7975 |
30.9 |
0.3 |
0.713 |
0 |
0 |
0 |
0.000 |
25 |
29 |
|
D |
3 |
2 |
7975 |
x |
D |
x-1/2,-y+1/2,-z-1 |
4_454 |
2 |
1 |
7975 |
26.4 |
-0.8 |
0.238 |
0 |
0 |
0 |
0.000 |
26 |
30 |
|
C |
2 |
1 |
7878 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
1 |
1 |
7782 |
6.3 |
-0.1 |
0.481 |
0 |
0 |
0 |
0.000 |
27 |
31 |
|
[HEM]A:142 |
1 |
1 |
840 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
7975 |
4.3 |
0.1 |
0.893 |
0 |
0 |
0 |
0.000 |
32 |
|
[HEM]C:142 |
1 |
1 |
842 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
8017 |
1.3 |
0.0 |
0.899 |
0 |
0 |
0 |
0.000 |
Average: |
2.8 |
0.1 |
0.896 |
0 |
0 |
0 |
0.000 |
28 |
33 |
|
C |
1 |
1 |
7878 |
◊ |
C |
-x,-y,z |
2_555 |
1 |
1 |
7878 |
4.2 |
-0.1 |
0.377 |
0 |
0 |
0 |
0.000 |
|