| ## |
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 |
|
D |
97 |
26 |
7983 |
◊ |
C |
x,y,z |
1_555 |
102 |
26 |
7774 |
897.3 |
-9.8 |
0.396 |
7 |
0 |
0 |
0.238 |
2 |
|
B |
86 |
24 |
7928 |
◊ |
A |
x,y,z |
1_555 |
91 |
25 |
7875 |
888.2 |
-9.6 |
0.353 |
8 |
0 |
0 |
0.238 |
| Average: |
892.7 |
-9.7 |
0.374 |
8 |
0 |
0 |
0.238 |
| 2 |
3 |
|
[HEM]A:142 |
43 |
1 |
852 |
f |
A |
x,y,z |
1_555 |
69 |
25 |
7875 |
571.1 |
-18.8 |
0.399 |
0 |
0 |
0 |
0.346 |
4 |
|
[HEM]C:142 |
43 |
1 |
836 |
f |
C |
x,y,z |
1_555 |
65 |
24 |
7774 |
570.1 |
-19.6 |
0.292 |
0 |
0 |
0 |
0.346 |
| Average: |
570.6 |
-19.2 |
0.345 |
0 |
0 |
0 |
0.346 |
| 3 |
5 |
|
[HEM]D:147 |
42 |
1 |
846 |
f |
D |
x,y,z |
1_555 |
64 |
25 |
7983 |
559.6 |
-19.4 |
0.274 |
0 |
0 |
0 |
0.343 |
6 |
|
[HEM]B:147 |
42 |
1 |
840 |
f |
B |
x,y,z |
1_555 |
65 |
27 |
7928 |
544.3 |
-18.9 |
0.248 |
0 |
0 |
0 |
0.343 |
| Average: |
551.9 |
-19.1 |
0.261 |
0 |
0 |
0 |
0.343 |
| 4 |
7 |
|
B |
55 |
11 |
7928 |
◊ |
C |
x,y,z |
1_555 |
50 |
13 |
7774 |
470.9 |
-3.1 |
0.585 |
4 |
0 |
0 |
0.074 |
8 |
|
D |
60 |
13 |
7983 |
◊ |
A |
x,y,z |
1_555 |
46 |
12 |
7875 |
453.8 |
-2.7 |
0.622 |
4 |
0 |
0 |
0.074 |
| Average: |
462.3 |
-2.9 |
0.604 |
4 |
0 |
0 |
0.074 |
| 5 |
9 |
|
C |
38 |
14 |
7774 |
◊ |
A |
x,y,z |
1_555 |
39 |
14 |
7875 |
396.0 |
-4.9 |
0.379 |
4 |
0 |
0 |
0.052 |
| 6 |
10 |
|
B |
33 |
11 |
7928 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
37 |
12 |
7928 |
328.2 |
1.7 |
0.808 |
5 |
0 |
0 |
0.000 |
| 7 |
11 |
|
A |
34 |
10 |
7875 |
◊ |
D |
x-1,y,z |
1_455 |
32 |
13 |
7983 |
307.5 |
-4.9 |
0.289 |
3 |
0 |
0 |
0.000 |
| 8 |
12 |
|
C |
20 |
7 |
7774 |
x |
C |
x-1/2,-y-1/2,-z+1 |
4_446 |
17 |
7 |
7774 |
180.5 |
1.8 |
0.863 |
3 |
3 |
0 |
0.000 |
| 9 |
13 |
|
A |
16 |
6 |
7875 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
16 |
8 |
7928 |
153.7 |
2.1 |
0.873 |
0 |
0 |
0 |
0.000 |
| 10 |
14 |
|
D |
17 |
4 |
7983 |
◊ |
B |
x,y,z |
1_555 |
16 |
4 |
7928 |
145.4 |
0.5 |
0.746 |
1 |
0 |
0 |
0.000 |
| 11 |
15 |
|
A |
14 |
5 |
7875 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
14 |
3 |
7774 |
92.0 |
-0.7 |
0.620 |
0 |
0 |
0 |
0.000 |
| 12 |
16 |
|
D |
9 |
3 |
7983 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
5 |
2 |
7928 |
77.8 |
-1.8 |
0.142 |
0 |
0 |
0 |
0.000 |
| 13 |
17 |
|
A |
9 |
3 |
7875 |
◊ |
[HEM]B:147 |
-x+1/2,-y,z-1/2 |
2_554 |
8 |
1 |
840 |
76.0 |
-2.2 |
0.717 |
1 |
0 |
0 |
0.000 |
| 14 |
18 |
|
[CYN]A:143 |
2 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
7875 |
68.4 |
-0.4 |
0.740 |
0 |
0 |
0 |
0.007 |
| 15 |
19 |
|
[CYN]C:143 |
2 |
1 |
144 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
7774 |
66.9 |
-0.6 |
0.662 |
0 |
0 |
0 |
0.010 |
| 16 |
20 |
|
[CYN]D:148 |
2 |
1 |
144 |
f |
D |
x,y,z |
1_555 |
10 |
7 |
7983 |
66.9 |
-0.5 |
0.671 |
0 |
0 |
0 |
0.009 |
| 17 |
21 |
|
[CYN]B:148 |
2 |
1 |
144 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
7928 |
65.1 |
-0.5 |
0.668 |
0 |
0 |
0 |
0.009 |
| 18 |
22 |
|
[HEM]C:142 |
8 |
1 |
836 |
◊ |
D |
x-1/2,-y-1/2,-z+1 |
4_446 |
6 |
2 |
7983 |
63.1 |
-1.9 |
0.799 |
1 |
0 |
0 |
0.000 |
| 19 |
23 |
|
B |
12 |
5 |
7928 |
◊ |
D |
x-1/2,-y+1/2,-z+1 |
4_456 |
8 |
4 |
7983 |
60.4 |
0.0 |
0.631 |
0 |
0 |
0 |
0.000 |
| 20 |
24 |
|
C |
4 |
3 |
7774 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
1 |
7983 |
53.3 |
0.0 |
0.485 |
0 |
0 |
0 |
0.000 |
| 21 |
25 |
|
[HEM]B:147 |
20 |
1 |
840 |
f |
[CYN]B:148 |
x,y,z |
1_555 |
2 |
1 |
144 |
47.9 |
-1.7 |
0.866 |
0 |
0 |
0 |
0.031 |
| 22 |
26 |
|
[HEM]A:142 |
19 |
1 |
852 |
f |
[CYN]A:143 |
x,y,z |
1_555 |
2 |
1 |
144 |
47.1 |
-1.7 |
0.866 |
0 |
0 |
0 |
0.030 |
| 23 |
27 |
|
[HEM]D:147 |
20 |
1 |
846 |
f |
[CYN]D:148 |
x,y,z |
1_555 |
2 |
1 |
144 |
46.9 |
-1.8 |
0.866 |
0 |
0 |
0 |
0.032 |
| 24 |
28 |
|
[HEM]C:142 |
18 |
1 |
836 |
f |
[CYN]C:143 |
x,y,z |
1_555 |
2 |
1 |
144 |
46.1 |
-1.9 |
0.500 |
0 |
0 |
0 |
0.034 |
| 25 |
29 |
|
C |
7 |
5 |
7774 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
6 |
2 |
7875 |
42.6 |
-0.4 |
0.591 |
0 |
0 |
0 |
0.000 |
| 26 |
30 |
|
[HEM]A:142 |
3 |
1 |
852 |
◊ |
C |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
2 |
7774 |
30.3 |
-2.3 |
0.204 |
0 |
0 |
0 |
0.000 |
| 27 |
31 |
|
B |
4 |
2 |
7928 |
◊ |
D |
x-1,y,z |
1_455 |
5 |
3 |
7983 |
25.2 |
0.3 |
0.746 |
0 |
0 |
0 |
0.000 |
| 28 |
32 |
|
C |
3 |
2 |
7774 |
◊ |
D |
x-1/2,-y-1/2,-z+1 |
4_446 |
5 |
2 |
7983 |
16.8 |
0.2 |
0.729 |
0 |
0 |
0 |
0.000 |
| 29 |
33 |
|
A |
1 |
1 |
7875 |
◊ |
[HEM]D:147 |
x-1,y,z |
1_455 |
1 |
1 |
846 |
7.9 |
0.2 |
0.722 |
0 |
0 |
0 |
0.000 |
| 30 |
34 |
|
D |
1 |
1 |
7983 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
1 |
1 |
7928 |
1.6 |
0.0 |
0.632 |
0 |
0 |
0 |
0.000 |
| 31 |
35 |
|
A |
1 |
1 |
7875 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
7928 |
1.0 |
0.0 |
0.773 |
0 |
0 |
0 |
0.000 |
|