## |
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 |
85 |
23 |
7832 |
◊ |
A |
x,y,z |
1_555 |
95 |
24 |
7622 |
883.1 |
-9.5 |
0.432 |
9 |
0 |
0 |
0.251 |
2 |
|
D |
92 |
23 |
7854 |
◊ |
C |
x,y,z |
1_555 |
84 |
24 |
7651 |
855.4 |
-10.8 |
0.321 |
8 |
0 |
0 |
0.251 |
Average: |
869.3 |
-10.1 |
0.376 |
9 |
0 |
0 |
0.251 |
2 |
3 |
|
[HEM]C:200 |
43 |
1 |
827 |
f |
C |
x,y,z |
1_555 |
71 |
28 |
7651 |
584.9 |
-19.7 |
0.370 |
1 |
0 |
0 |
0.368 |
4 |
|
[HEM]A:200 |
43 |
1 |
834 |
f |
A |
x,y,z |
1_555 |
71 |
27 |
7622 |
583.4 |
-19.5 |
0.378 |
1 |
0 |
0 |
0.368 |
Average: |
584.2 |
-19.6 |
0.374 |
1 |
0 |
0 |
0.368 |
3 |
5 |
|
[HEM]B:200 |
42 |
1 |
808 |
f |
B |
x,y,z |
1_555 |
64 |
23 |
7832 |
525.3 |
-17.9 |
0.272 |
0 |
0 |
0 |
0.330 |
6 |
|
[HEM]D:200 |
43 |
1 |
817 |
f |
D |
x,y,z |
1_555 |
61 |
24 |
7854 |
525.3 |
-17.8 |
0.252 |
0 |
0 |
0 |
0.330 |
Average: |
525.3 |
-17.8 |
0.262 |
0 |
0 |
0 |
0.330 |
4 |
7 |
|
B |
55 |
14 |
7832 |
◊ |
C |
x,y,z |
1_555 |
51 |
12 |
7651 |
470.4 |
-3.2 |
0.628 |
2 |
0 |
0 |
0.007 |
8 |
|
D |
55 |
13 |
7854 |
◊ |
A |
x,y,z |
1_555 |
49 |
12 |
7622 |
436.8 |
-4.1 |
0.556 |
1 |
0 |
0 |
0.007 |
Average: |
453.6 |
-3.6 |
0.592 |
2 |
0 |
0 |
0.007 |
5 |
9 |
|
C |
35 |
10 |
7651 |
◊ |
A |
x,y,z |
1_555 |
29 |
9 |
7622 |
296.8 |
-3.4 |
0.478 |
1 |
2 |
0 |
0.003 |
6 |
10 |
|
B |
29 |
10 |
7832 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
35 |
12 |
7651 |
272.0 |
0.5 |
0.811 |
0 |
0 |
0 |
0.000 |
7 |
11 |
|
A |
25 |
5 |
7622 |
◊ |
D |
-x+1,y-1/2,-z-1/2 |
3_644 |
21 |
7 |
7854 |
167.1 |
-0.9 |
0.639 |
3 |
0 |
0 |
0.000 |
8 |
12 |
|
D |
21 |
5 |
7854 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
24 |
6 |
7651 |
166.1 |
0.1 |
0.752 |
1 |
1 |
0 |
0.000 |
9 |
13 |
|
D |
23 |
10 |
7854 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
23 |
7 |
7832 |
161.8 |
-1.1 |
0.625 |
2 |
1 |
0 |
0.000 |
10 |
14 |
|
A |
21 |
8 |
7622 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
18 |
6 |
7832 |
153.5 |
1.0 |
0.840 |
3 |
4 |
0 |
0.000 |
11 |
15 |
|
D |
12 |
4 |
7854 |
◊ |
A |
-x+3/2,-y,z-1/2 |
2_654 |
14 |
5 |
7622 |
138.0 |
-0.9 |
0.518 |
2 |
1 |
0 |
0.000 |
12 |
16 |
|
[CIN]D:300 |
12 |
1 |
347 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
13 |
4 |
7651 |
121.0 |
2.1 |
0.064 |
1 |
0 |
0 |
0.000 |
13 |
17 |
|
D |
15 |
6 |
7854 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
7832 |
102.7 |
2.4 |
0.917 |
1 |
0 |
0 |
0.000 |
14 |
18 |
|
[CIN]D:300 |
9 |
1 |
347 |
cf |
B |
x,y,z |
1_555 |
7 |
2 |
7832 |
84.7 |
2.4 |
0.133 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[CMO]B:201 |
2 |
1 |
136 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
7832 |
67.2 |
-1.1 |
0.624 |
0 |
0 |
0 |
0.020 |
16 |
20 |
|
[CMO]A:201 |
2 |
1 |
136 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
7622 |
67.2 |
-0.9 |
0.710 |
0 |
0 |
0 |
0.016 |
17 |
21 |
|
[CMO]D:301 |
2 |
1 |
136 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
7854 |
63.3 |
-0.3 |
0.754 |
1 |
0 |
0 |
0.014 |
18 |
22 |
|
[CMO]C:201 |
2 |
1 |
136 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
7651 |
63.1 |
-0.7 |
0.698 |
0 |
0 |
0 |
0.012 |
19 |
23 |
|
C |
6 |
2 |
7651 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
13 |
4 |
7832 |
61.2 |
-0.8 |
0.362 |
0 |
0 |
0 |
0.000 |
20 |
24 |
|
[CIN]D:300 |
4 |
1 |
347 |
c |
D |
x,y,z |
1_555 |
7 |
2 |
7854 |
60.2 |
3.0 |
0.443 |
0 |
0 |
0 |
0.000 |
21 |
25 |
|
[CIN]D:300 |
5 |
1 |
347 |
◊ |
[HEM]C:200 |
x-1/2,-y+1/2,-z |
4_455 |
5 |
1 |
827 |
51.9 |
0.3 |
0.291 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[CMO]A:201 |
2 |
1 |
136 |
cf |
[HEM]A:200 |
x,y,z |
1_555 |
17 |
1 |
834 |
46.8 |
-1.6 |
0.866 |
0 |
0 |
0 |
0.030 |
23 |
27 |
|
[CMO]C:201 |
2 |
1 |
136 |
cf |
[HEM]C:200 |
x,y,z |
1_555 |
18 |
1 |
827 |
46.1 |
-1.8 |
0.500 |
0 |
0 |
0 |
0.031 |
24 |
28 |
|
[CMO]B:201 |
2 |
1 |
136 |
cf |
[HEM]B:200 |
x,y,z |
1_555 |
17 |
1 |
808 |
45.9 |
-1.8 |
0.866 |
0 |
0 |
0 |
0.033 |
25 |
29 |
|
B |
5 |
2 |
7832 |
◊ |
[HEM]C:200 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
827 |
45.8 |
-0.9 |
0.721 |
1 |
0 |
0 |
0.000 |
26 |
30 |
|
[CMO]D:301 |
2 |
1 |
136 |
cf |
[HEM]D:200 |
x,y,z |
1_555 |
17 |
1 |
817 |
45.3 |
-1.7 |
0.866 |
0 |
0 |
0 |
0.030 |
27 |
31 |
|
C |
4 |
3 |
7651 |
◊ |
A |
-x+3/2,-y,z-1/2 |
2_654 |
3 |
2 |
7622 |
40.7 |
-1.3 |
0.185 |
0 |
0 |
0 |
0.000 |
28 |
32 |
|
D |
3 |
1 |
7854 |
x |
D |
-x+1,y-1/2,-z-1/2 |
3_644 |
2 |
2 |
7854 |
11.6 |
-0.1 |
0.530 |
0 |
0 |
0 |
0.000 |
29 |
33 |
|
D |
1 |
1 |
7854 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
7622 |
9.2 |
-0.3 |
0.259 |
0 |
0 |
0 |
0.000 |
30 |
34 |
|
D |
1 |
1 |
7854 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
1 |
1 |
7832 |
2.3 |
0.1 |
0.786 |
0 |
0 |
0 |
0.000 |
|