## |
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 |
282 |
67 |
10513 |
◊ |
A |
x,y,z |
1_555 |
279 |
68 |
10695 |
2813.0 |
-46.2 |
0.033 |
16 |
11 |
0 |
0.434 |
2 |
2 |
|
[HEM]B:202 |
36 |
1 |
816 |
◊ |
A |
x,y,z |
1_555 |
37 |
12 |
10695 |
339.6 |
-11.4 |
0.388 |
1 |
0 |
0 |
0.173 |
3 |
|
[HEM]A:201 |
36 |
1 |
803 |
◊ |
B |
x,y,z |
1_555 |
35 |
12 |
10513 |
332.8 |
-9.7 |
0.591 |
1 |
0 |
0 |
0.173 |
Average: |
336.2 |
-10.5 |
0.490 |
1 |
0 |
0 |
0.173 |
3 |
4 |
|
[HEM]B:202 |
38 |
1 |
816 |
f |
B |
x,y,z |
1_555 |
39 |
14 |
10513 |
337.4 |
-12.2 |
0.427 |
2 |
0 |
0 |
0.206 |
5 |
|
[HEM]A:201 |
36 |
1 |
803 |
f |
A |
x,y,z |
1_555 |
40 |
14 |
10695 |
326.9 |
-12.1 |
0.408 |
2 |
0 |
0 |
0.206 |
Average: |
332.2 |
-12.1 |
0.417 |
2 |
0 |
0 |
0.206 |
4 |
6 |
|
B |
33 |
8 |
10513 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
39 |
10 |
10695 |
306.1 |
-0.0 |
0.774 |
6 |
0 |
0 |
0.000 |
5 |
7 |
|
A |
26 |
10 |
10695 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
31 |
10 |
10513 |
247.2 |
-1.5 |
0.600 |
2 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
21 |
6 |
10513 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
21 |
9 |
10695 |
165.8 |
-0.3 |
0.704 |
2 |
1 |
0 |
0.000 |
7 |
9 |
|
B |
15 |
5 |
10513 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
19 |
7 |
10695 |
144.0 |
0.3 |
0.739 |
1 |
1 |
0 |
0.000 |
8 |
10 |
|
B |
15 |
4 |
10513 |
x |
B |
x,y-1,z |
1_545 |
16 |
6 |
10513 |
125.1 |
-0.4 |
0.611 |
3 |
0 |
0 |
0.000 |
9 |
11 |
|
B |
14 |
5 |
10513 |
x |
B |
-x-1/2,-y-1,z-1/2 |
2_444 |
11 |
3 |
10513 |
105.8 |
0.7 |
0.773 |
0 |
0 |
0 |
0.000 |
10 |
12 |
|
A |
7 |
2 |
10695 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
11 |
5 |
10695 |
97.0 |
-0.7 |
0.577 |
0 |
0 |
0 |
0.000 |
11 |
13 |
|
B |
6 |
4 |
10513 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
9 |
4 |
10513 |
63.8 |
1.3 |
0.840 |
0 |
1 |
0 |
0.000 |
12 |
14 |
|
A |
2 |
1 |
10695 |
x |
A |
x-1/2,-y-3/2,-z |
4_435 |
9 |
5 |
10695 |
57.1 |
0.9 |
0.795 |
0 |
0 |
0 |
0.000 |
13 |
15 |
|
[CO]B:203 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
10513 |
53.4 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.118 |
16 |
|
[CO]A:203 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
10695 |
53.4 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.118 |
Average: |
53.4 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.118 |
14 |
17 |
|
A |
10 |
5 |
10695 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
10513 |
51.6 |
-0.3 |
0.542 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
A |
3 |
2 |
10695 |
◊ |
B |
-x-1/2,-y-1,z-1/2 |
2_444 |
8 |
3 |
10513 |
51.1 |
1.2 |
0.854 |
0 |
0 |
0 |
0.000 |
16 |
19 |
|
[CO]A:203 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
10513 |
47.6 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.076 |
20 |
|
[CO]B:203 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
10695 |
47.3 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.076 |
Average: |
47.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.076 |
17 |
21 |
|
[O]A:202 |
1 |
1 |
99 |
f |
[HEM]B:202 |
x,y,z |
1_555 |
13 |
1 |
816 |
32.9 |
-0.3 |
1.000 |
0 |
0 |
0 |
0.005 |
22 |
|
[O]B:201 |
1 |
1 |
99 |
f |
[HEM]A:201 |
x,y,z |
1_555 |
14 |
1 |
803 |
32.7 |
-0.3 |
1.000 |
0 |
0 |
0 |
0.005 |
Average: |
32.8 |
-0.3 |
1.000 |
0 |
0 |
0 |
0.005 |
18 |
23 |
|
[O]A:202 |
1 |
1 |
99 |
◊ |
A |
x,y,z |
1_555 |
6 |
4 |
10695 |
32.1 |
0.2 |
0.729 |
0 |
0 |
0 |
0.000 |
24 |
|
[O]B:201 |
1 |
1 |
99 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
10513 |
32.1 |
0.2 |
0.725 |
0 |
0 |
0 |
0.000 |
Average: |
32.1 |
0.2 |
0.727 |
0 |
0 |
0 |
0.000 |
19 |
25 |
|
A |
3 |
1 |
10695 |
◊ |
B |
x,y-1,z |
1_545 |
6 |
2 |
10513 |
28.7 |
-0.2 |
0.510 |
0 |
0 |
0 |
0.000 |
20 |
26 |
|
A |
3 |
2 |
10695 |
x |
A |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
2 |
10695 |
21.8 |
0.8 |
0.849 |
0 |
0 |
0 |
0.000 |
21 |
27 |
|
B |
1 |
1 |
10513 |
◊ |
[HEM]B:202 |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
1 |
816 |
16.9 |
-0.6 |
0.754 |
0 |
0 |
0 |
0.000 |
22 |
28 |
|
[O]A:202 |
1 |
1 |
99 |
f |
B |
x,y,z |
1_555 |
2 |
2 |
10513 |
14.9 |
0.5 |
0.948 |
0 |
0 |
0 |
0.000 |
29 |
|
[O]B:201 |
1 |
1 |
99 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
10695 |
14.7 |
0.6 |
0.937 |
0 |
0 |
0 |
0.000 |
Average: |
14.8 |
0.6 |
0.943 |
0 |
0 |
0 |
0.000 |
23 |
30 |
|
B |
3 |
1 |
10513 |
◊ |
A |
-x-1/2,-y-1,z-1/2 |
2_444 |
1 |
1 |
10695 |
14.7 |
0.7 |
0.838 |
0 |
0 |
0 |
0.000 |
24 |
31 |
|
A |
2 |
1 |
10695 |
◊ |
[HEM]B:202 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
816 |
4.5 |
-0.2 |
0.570 |
0 |
0 |
0 |
0.000 |
25 |
32 |
|
B |
1 |
1 |
10513 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
2 |
2 |
10695 |
3.5 |
-0.1 |
0.551 |
0 |
0 |
0 |
0.000 |
26 |
33 |
|
A |
2 |
1 |
10695 |
◊ |
[HEM]A:201 |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
803 |
3.3 |
-0.1 |
0.727 |
0 |
0 |
0 |
0.000 |
27 |
34 |
|
B |
1 |
1 |
10513 |
x |
B |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
10513 |
1.8 |
0.0 |
0.641 |
0 |
0 |
0 |
0.000 |
28 |
35 |
|
B |
1 |
1 |
10513 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
10695 |
1.1 |
0.0 |
0.770 |
0 |
0 |
0 |
0.000 |
29 |
36 |
|
B |
1 |
1 |
10513 |
x |
B |
x-1/2,-y-3/2,-z |
4_435 |
1 |
1 |
10513 |
0.7 |
0.0 |
0.758 |
0 |
0 |
0 |
0.000 |
30 |
37 |
|
A |
1 |
1 |
10695 |
x |
A |
x,y-1,z |
1_545 |
1 |
1 |
10695 |
0.4 |
0.0 |
0.758 |
0 |
0 |
0 |
0.000 |
|