## |
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 |
|
[HEM]B:139 |
43 |
1 |
811 |
f |
B |
x,y,z |
1_555 |
81 |
25 |
7493 |
600.8 |
-20.1 |
0.264 |
1 |
0 |
0 |
0.058 |
2 |
|
[HEM]A:139 |
43 |
1 |
844 |
f |
A |
x,y,z |
1_555 |
75 |
22 |
7495 |
569.7 |
-17.5 |
0.312 |
0 |
0 |
0 |
0.058 |
Average: |
585.3 |
-18.8 |
0.288 |
1 |
0 |
0 |
0.058 |
2 |
3 |
|
A |
54 |
15 |
7495 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
56 |
13 |
7493 |
474.4 |
2.4 |
0.768 |
3 |
2 |
0 |
0.000 |
3 |
4 |
|
B |
32 |
9 |
7493 |
◊ |
A |
-x+1/2,-y-1,z-1/2 |
2_544 |
39 |
13 |
7495 |
303.9 |
-1.8 |
0.411 |
3 |
2 |
0 |
0.000 |
5 |
|
A |
30 |
9 |
7495 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
42 |
14 |
7493 |
303.3 |
-1.3 |
0.454 |
4 |
2 |
0 |
0.000 |
Average: |
303.6 |
-1.5 |
0.432 |
4 |
2 |
0 |
0.000 |
4 |
6 |
|
B |
24 |
8 |
7493 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
26 |
8 |
7495 |
227.1 |
-0.8 |
0.478 |
1 |
0 |
0 |
0.000 |
5 |
7 |
|
B |
23 |
7 |
7493 |
◊ |
A |
x,y,z |
1_555 |
23 |
6 |
7495 |
219.5 |
-2.4 |
0.275 |
2 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
22 |
9 |
7493 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
23 |
9 |
7495 |
199.1 |
1.5 |
0.744 |
1 |
7 |
0 |
0.000 |
7 |
9 |
|
B |
21 |
5 |
7493 |
x |
B |
-x+1/2,-y,z-1/2 |
2_554 |
21 |
6 |
7493 |
197.2 |
-1.3 |
0.399 |
4 |
0 |
0 |
0.000 |
8 |
10 |
|
A |
19 |
5 |
7495 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
17 |
6 |
7495 |
168.2 |
-1.2 |
0.385 |
0 |
0 |
0 |
0.000 |
9 |
11 |
|
A |
14 |
5 |
7495 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
12 |
7 |
7493 |
121.5 |
-0.8 |
0.436 |
0 |
0 |
0 |
0.000 |
10 |
12 |
|
A |
12 |
5 |
7495 |
x |
A |
-x+1/2,-y-1,z-1/2 |
2_544 |
18 |
5 |
7495 |
111.1 |
0.9 |
0.634 |
1 |
0 |
0 |
0.000 |
13 |
|
B |
14 |
4 |
7493 |
x |
B |
-x,y-1/2,-z-1/2 |
3_544 |
10 |
3 |
7493 |
104.9 |
0.4 |
0.631 |
1 |
2 |
0 |
0.000 |
Average: |
108.0 |
0.6 |
0.633 |
1 |
1 |
0 |
0.000 |
11 |
14 |
|
[SO4]B:197 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
7493 |
86.3 |
-12.5 |
0.702 |
1 |
0 |
0 |
0.036 |
12 |
15 |
|
[SO4]A:196 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
7495 |
73.8 |
-11.0 |
0.646 |
1 |
0 |
0 |
0.027 |
13 |
16 |
|
B |
10 |
6 |
7493 |
◊ |
[SO4]A:196 |
-x+1/2,-y-1,z-1/2 |
2_544 |
4 |
1 |
185 |
70.2 |
-10.5 |
0.630 |
2 |
0 |
0 |
0.000 |
14 |
17 |
|
[SO4]A:195 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
7495 |
69.9 |
-10.8 |
0.593 |
2 |
0 |
0 |
0.027 |
15 |
18 |
|
[SO4]A:195 |
5 |
1 |
185 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
13 |
5 |
7493 |
69.7 |
-10.4 |
0.648 |
1 |
0 |
0 |
0.000 |
16 |
19 |
|
[CYN]B:189 |
2 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
7493 |
64.3 |
-0.1 |
0.678 |
0 |
0 |
0 |
0.000 |
17 |
20 |
|
[CYN]A:188 |
2 |
1 |
143 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
7495 |
63.9 |
-0.1 |
0.685 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
[CYN]B:189 |
2 |
1 |
144 |
f |
[HEM]B:139 |
x,y,z |
1_555 |
18 |
1 |
811 |
47.0 |
-1.9 |
0.500 |
0 |
0 |
0 |
0.005 |
19 |
22 |
|
[CYN]A:188 |
2 |
1 |
143 |
f |
[HEM]A:139 |
x,y,z |
1_555 |
19 |
1 |
844 |
45.8 |
-1.8 |
0.500 |
0 |
0 |
0 |
0.004 |
20 |
23 |
|
[SO4]B:197 |
4 |
1 |
185 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
5 |
2 |
7495 |
39.9 |
-3.7 |
0.950 |
1 |
0 |
0 |
0.000 |
21 |
24 |
|
A |
3 |
1 |
7495 |
◊ |
[SO4]B:197 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
185 |
16.0 |
-2.0 |
0.713 |
0 |
0 |
0 |
0.000 |
|