## |
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 |
245 |
58 |
9184 |
◊ |
A |
x,y,z |
1_555 |
225 |
52 |
8643 |
2278.2 |
-34.6 |
0.215 |
17 |
1 |
0 |
0.230 |
2 |
2 |
|
[HEM]B:201 |
43 |
1 |
848 |
cf |
B |
x,y,z |
1_555 |
68 |
27 |
9184 |
543.2 |
-21.5 |
0.407 |
5 |
0 |
0 |
0.260 |
3 |
|
[HEM]A:201 |
43 |
1 |
850 |
cf |
A |
x,y,z |
1_555 |
68 |
32 |
8643 |
527.9 |
-21.1 |
0.379 |
5 |
0 |
0 |
0.260 |
Average: |
535.5 |
-21.3 |
0.393 |
5 |
0 |
0 |
0.260 |
3 |
4 |
|
[6UZ]B:202 |
27 |
1 |
761 |
f |
B |
x,y,z |
1_555 |
53 |
15 |
9184 |
381.4 |
-7.5 |
0.665 |
1 |
0 |
0 |
0.043 |
4 |
5 |
|
[6UZ]A:202 |
25 |
1 |
754 |
f |
A |
x,y,z |
1_555 |
52 |
16 |
8643 |
360.3 |
-11.7 |
0.436 |
1 |
0 |
0 |
0.135 |
5 |
6 |
|
A |
40 |
10 |
8643 |
◊ |
A |
-x,-y,z |
2_555 |
40 |
10 |
8643 |
342.4 |
-4.8 |
0.490 |
4 |
0 |
0 |
0.037 |
7 |
|
B |
45 |
12 |
9184 |
◊ |
B |
-x,-y,z |
2_555 |
44 |
12 |
9184 |
341.3 |
-3.2 |
0.651 |
6 |
0 |
0 |
0.037 |
Average: |
341.9 |
-4.0 |
0.570 |
5 |
0 |
0 |
0.037 |
6 |
8 |
|
B |
32 |
12 |
9184 |
x |
B |
x-1/2,-y+1/2,-z-1 |
4_454 |
23 |
10 |
9184 |
253.6 |
-1.5 |
0.653 |
2 |
0 |
0 |
0.000 |
7 |
9 |
|
A |
22 |
10 |
8643 |
x |
A |
-x-1/2,y-1/2,-z |
3_445 |
32 |
13 |
8643 |
236.4 |
0.3 |
0.725 |
3 |
0 |
0 |
0.000 |
8 |
10 |
|
B |
35 |
12 |
9184 |
x |
B |
-x-1/2,y-1/2,-z-1 |
3_444 |
22 |
5 |
9184 |
225.0 |
-2.0 |
0.467 |
3 |
1 |
0 |
0.000 |
9 |
11 |
|
[HEM]A:201 |
22 |
1 |
850 |
◊ |
B |
x,y,z |
1_555 |
19 |
6 |
9184 |
177.0 |
-5.0 |
0.561 |
0 |
0 |
0 |
0.052 |
12 |
|
[HEM]B:201 |
22 |
1 |
848 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
8643 |
171.4 |
-4.6 |
0.571 |
0 |
0 |
0 |
0.052 |
Average: |
174.2 |
-4.8 |
0.566 |
0 |
0 |
0 |
0.052 |
10 |
13 |
|
B |
20 |
6 |
9184 |
◊ |
A |
-x-1/2,y-1/2,-z |
3_445 |
16 |
4 |
8643 |
173.3 |
-1.4 |
0.609 |
2 |
0 |
0 |
0.000 |
11 |
14 |
|
A |
18 |
4 |
8643 |
◊ |
A |
-x-1,-y,z |
2_455 |
18 |
4 |
8643 |
141.0 |
-0.7 |
0.678 |
0 |
0 |
0 |
0.000 |
12 |
15 |
|
B |
18 |
4 |
9184 |
◊ |
A |
-x-1/2,y-1/2,-z-1 |
3_444 |
17 |
4 |
8643 |
132.9 |
-2.2 |
0.503 |
0 |
0 |
0 |
0.000 |
13 |
16 |
|
B |
14 |
5 |
9184 |
◊ |
B |
-x,-y+1,z |
2_565 |
14 |
5 |
9184 |
126.4 |
-2.2 |
0.457 |
0 |
0 |
0 |
0.000 |
14 |
17 |
|
[6UZ]A:202 |
12 |
1 |
754 |
◊ |
B |
-x-1,-y,z |
2_455 |
14 |
4 |
9184 |
122.7 |
0.7 |
0.793 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
[SO4]A:205 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
17 |
7 |
8643 |
118.4 |
-18.9 |
0.737 |
3 |
0 |
0 |
0.225 |
16 |
19 |
|
[SO4]A:203 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
8643 |
74.0 |
-10.6 |
0.830 |
4 |
0 |
0 |
0.138 |
17 |
20 |
|
[6UZ]A:202 |
10 |
1 |
754 |
◊ |
A |
-x-1,-y,z |
2_455 |
6 |
2 |
8643 |
68.8 |
-0.2 |
0.617 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
[6UZ]A:202 |
4 |
1 |
754 |
f |
[HEM]A:201 |
x,y,z |
1_555 |
11 |
1 |
850 |
66.7 |
-5.7 |
0.335 |
0 |
0 |
0 |
0.064 |
19 |
22 |
|
[SO4]B:203 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
9184 |
65.7 |
-9.2 |
0.802 |
1 |
0 |
0 |
0.052 |
20 |
23 |
|
[6UZ]B:202 |
3 |
1 |
761 |
f |
[HEM]B:201 |
x,y,z |
1_555 |
9 |
1 |
848 |
61.3 |
-7.0 |
0.283 |
0 |
0 |
0 |
0.038 |
21 |
24 |
|
[SO4]A:204 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
8643 |
60.9 |
-8.3 |
0.805 |
2 |
0 |
0 |
0.103 |
22 |
25 |
|
A |
7 |
3 |
8643 |
◊ |
[SO4]A:204 |
-x-1/2,y-1/2,-z |
3_445 |
4 |
1 |
185 |
59.9 |
-6.8 |
0.906 |
2 |
0 |
0 |
0.000 |
23 |
26 |
|
[SO4]A:203 |
5 |
1 |
185 |
◊ |
A |
-x-1/2,y-1/2,-z |
3_445 |
7 |
3 |
8643 |
38.4 |
-5.2 |
0.829 |
1 |
0 |
0 |
0.000 |
24 |
27 |
|
B |
5 |
3 |
9184 |
◊ |
A |
-x-1,-y,z |
2_455 |
6 |
2 |
8643 |
35.0 |
0.7 |
0.805 |
0 |
0 |
0 |
0.000 |
25 |
28 |
|
[HEM]B:201 |
1 |
1 |
848 |
◊ |
B |
-x,-y,z |
2_555 |
1 |
1 |
9184 |
25.3 |
-0.8 |
0.198 |
0 |
0 |
0 |
0.007 |
29 |
|
[HEM]A:201 |
1 |
1 |
850 |
◊ |
A |
-x,-y,z |
2_555 |
2 |
1 |
8643 |
19.8 |
-0.6 |
0.345 |
0 |
0 |
0 |
0.007 |
Average: |
22.6 |
-0.7 |
0.272 |
0 |
0 |
0 |
0.007 |
26 |
30 |
|
[6UZ]B:202 |
4 |
1 |
761 |
◊ |
B |
x-1/2,-y+1/2,-z-1 |
4_454 |
4 |
1 |
9184 |
21.3 |
-0.2 |
0.663 |
0 |
0 |
0 |
0.000 |
27 |
31 |
|
[SO4]A:204 |
3 |
1 |
185 |
◊ |
A |
-x,-y,z |
2_555 |
4 |
1 |
8643 |
20.0 |
-2.7 |
0.689 |
0 |
0 |
0 |
0.030 |
28 |
32 |
|
[SO4]A:203 |
2 |
1 |
185 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
3 |
1 |
8643 |
16.9 |
-2.3 |
0.649 |
0 |
0 |
0 |
0.000 |
29 |
33 |
|
[SO4]A:203 |
3 |
1 |
185 |
◊ |
[SO4]A:204 |
-x-1/2,y-1/2,-z |
3_445 |
1 |
1 |
185 |
13.4 |
-3.0 |
0.891 |
0 |
0 |
0 |
0.000 |
30 |
34 |
|
B |
2 |
1 |
9184 |
◊ |
A |
x-1/2,-y+1/2,-z-1 |
4_454 |
3 |
1 |
8643 |
10.5 |
-0.1 |
0.576 |
0 |
0 |
0 |
0.000 |
31 |
35 |
|
A |
1 |
1 |
8643 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
8643 |
5.1 |
0.1 |
0.594 |
0 |
0 |
0 |
0.000 |
32 |
36 |
|
[SO4]A:203 |
1 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
9184 |
4.6 |
-0.6 |
0.591 |
0 |
0 |
0 |
0.003 |
33 |
37 |
|
B |
1 |
1 |
9184 |
◊ |
B |
-x-1,-y,z |
2_455 |
1 |
1 |
9184 |
3.7 |
0.3 |
0.856 |
0 |
0 |
0 |
0.000 |
34 |
38 |
|
B |
1 |
1 |
9184 |
◊ |
A |
-x,-y,z |
2_555 |
1 |
1 |
8643 |
1.9 |
-0.1 |
0.530 |
0 |
0 |
0 |
0.000 |
|