## |
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 |
95 |
25 |
7548 |
◊ |
A |
x,y,z |
1_555 |
96 |
28 |
7741 |
852.0 |
-1.3 |
0.677 |
12 |
6 |
0 |
0.139 |
2 |
|
D |
97 |
26 |
7697 |
◊ |
C |
x,y,z |
1_555 |
91 |
27 |
7688 |
849.2 |
-2.5 |
0.619 |
11 |
8 |
0 |
0.139 |
Average: |
850.6 |
-1.9 |
0.648 |
12 |
7 |
0 |
0.139 |
2 |
3 |
|
[HEM]D:147 |
43 |
1 |
844 |
f |
D |
x,y,z |
1_555 |
75 |
25 |
7697 |
611.6 |
-20.0 |
0.389 |
1 |
0 |
0 |
0.684 |
4 |
|
[HEM]A:147 |
43 |
1 |
834 |
f |
A |
x,y,z |
1_555 |
74 |
25 |
7741 |
605.9 |
-18.6 |
0.390 |
2 |
0 |
0 |
0.684 |
5 |
|
[HEM]B:147 |
42 |
1 |
833 |
f |
B |
x,y,z |
1_555 |
83 |
25 |
7548 |
604.8 |
-20.1 |
0.368 |
2 |
0 |
0 |
0.684 |
6 |
|
[HEM]C:147 |
43 |
1 |
835 |
f |
C |
x,y,z |
1_555 |
81 |
25 |
7688 |
597.2 |
-19.9 |
0.318 |
2 |
0 |
0 |
0.684 |
Average: |
604.9 |
-19.7 |
0.367 |
2 |
0 |
0 |
0.684 |
3 |
7 |
|
A |
40 |
12 |
7741 |
◊ |
C |
x,y-1,z-1 |
1_544 |
39 |
11 |
7688 |
382.2 |
-2.0 |
0.461 |
2 |
2 |
0 |
0.000 |
4 |
8 |
|
A |
41 |
11 |
7741 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
38 |
13 |
7697 |
362.3 |
1.1 |
0.763 |
6 |
7 |
0 |
0.000 |
5 |
9 |
|
D |
40 |
11 |
7697 |
◊ |
B |
x-1,y,z |
1_455 |
34 |
10 |
7548 |
295.3 |
-2.6 |
0.459 |
3 |
1 |
0 |
0.000 |
6 |
10 |
|
A |
25 |
10 |
7741 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
9 |
7688 |
267.4 |
0.0 |
0.593 |
1 |
1 |
0 |
0.000 |
11 |
|
B |
34 |
10 |
7548 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
28 |
11 |
7697 |
267.1 |
-0.5 |
0.625 |
2 |
1 |
0 |
0.000 |
Average: |
267.2 |
-0.2 |
0.609 |
2 |
1 |
0 |
0.000 |
7 |
12 |
|
D |
28 |
9 |
7697 |
x |
D |
-x,y-1/2,-z+1 |
2_546 |
33 |
12 |
7697 |
245.2 |
1.0 |
0.777 |
4 |
0 |
0 |
0.000 |
8 |
13 |
|
B |
23 |
7 |
7548 |
x |
B |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
11 |
7548 |
234.4 |
-3.0 |
0.340 |
3 |
1 |
0 |
0.000 |
9 |
14 |
|
A |
22 |
9 |
7741 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
25 |
12 |
7741 |
198.0 |
1.8 |
0.792 |
1 |
0 |
0 |
0.000 |
10 |
15 |
|
A |
20 |
5 |
7741 |
◊ |
B |
x,y-1,z |
1_545 |
17 |
7 |
7548 |
166.1 |
-0.4 |
0.532 |
3 |
0 |
0 |
0.000 |
16 |
|
D |
15 |
5 |
7697 |
◊ |
C |
x,y-1,z |
1_545 |
11 |
5 |
7688 |
126.1 |
-0.5 |
0.524 |
2 |
0 |
0 |
0.000 |
Average: |
146.1 |
-0.4 |
0.528 |
3 |
0 |
0 |
0.000 |
11 |
17 |
|
C |
19 |
6 |
7688 |
x |
C |
x,y-1,z |
1_545 |
17 |
7 |
7688 |
155.7 |
0.7 |
0.702 |
1 |
0 |
0 |
0.000 |
12 |
18 |
|
B |
16 |
6 |
7548 |
x |
B |
x,y-1,z |
1_545 |
15 |
5 |
7548 |
153.1 |
0.3 |
0.648 |
1 |
1 |
0 |
0.000 |
13 |
19 |
|
C |
7 |
3 |
7688 |
x |
C |
-x,y-1/2,-z+2 |
2_547 |
12 |
5 |
7688 |
78.5 |
-0.3 |
0.548 |
0 |
0 |
0 |
0.000 |
14 |
20 |
|
[HEM]D:147 |
5 |
1 |
844 |
◊ |
C |
x,y,z |
1_555 |
10 |
4 |
7688 |
74.2 |
-3.4 |
0.329 |
1 |
0 |
0 |
0.107 |
21 |
|
[HEM]C:147 |
6 |
1 |
835 |
◊ |
D |
x,y,z |
1_555 |
9 |
3 |
7697 |
73.2 |
-2.4 |
0.503 |
1 |
0 |
0 |
0.107 |
22 |
|
[HEM]B:147 |
4 |
1 |
833 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
7741 |
69.1 |
-2.9 |
0.266 |
1 |
0 |
0 |
0.107 |
23 |
|
[HEM]A:147 |
5 |
1 |
834 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
7548 |
64.0 |
-2.3 |
0.483 |
0 |
0 |
0 |
0.107 |
Average: |
70.1 |
-2.7 |
0.395 |
1 |
0 |
0 |
0.107 |
15 |
24 |
|
A |
6 |
2 |
7741 |
x |
A |
x,y-1,z |
1_545 |
10 |
3 |
7741 |
62.1 |
2.1 |
0.890 |
1 |
1 |
0 |
0.000 |
25 |
|
D |
5 |
2 |
7697 |
x |
D |
x,y-1,z |
1_545 |
2 |
1 |
7697 |
22.0 |
0.9 |
0.836 |
1 |
1 |
0 |
0.000 |
Average: |
42.1 |
1.5 |
0.863 |
1 |
1 |
0 |
0.000 |
16 |
26 |
|
[CMO]B:148 |
2 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
7548 |
62.1 |
-0.3 |
0.732 |
1 |
0 |
0 |
0.013 |
17 |
27 |
|
[CMO]A:148 |
2 |
1 |
138 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
7741 |
62.0 |
-0.4 |
0.703 |
1 |
0 |
0 |
0.014 |
18 |
28 |
|
[CMO]C:148 |
2 |
1 |
138 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
7688 |
61.4 |
-0.3 |
0.703 |
1 |
0 |
0 |
0.013 |
19 |
29 |
|
[CMO]D:148 |
2 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
7697 |
60.7 |
-0.3 |
0.728 |
1 |
0 |
0 |
0.012 |
20 |
30 |
|
[CMO]A:148 |
2 |
1 |
138 |
f |
[HEM]A:147 |
x,y,z |
1_555 |
17 |
1 |
834 |
44.8 |
-1.9 |
0.500 |
0 |
0 |
0 |
0.032 |
21 |
31 |
|
[CMO]C:148 |
2 |
1 |
138 |
f |
[HEM]C:147 |
x,y,z |
1_555 |
17 |
1 |
835 |
44.4 |
-1.9 |
0.500 |
0 |
0 |
0 |
0.031 |
22 |
32 |
|
[CMO]D:148 |
2 |
1 |
137 |
cf |
[HEM]D:147 |
x,y,z |
1_555 |
17 |
1 |
844 |
44.1 |
-2.0 |
0.500 |
0 |
0 |
0 |
0.032 |
23 |
33 |
|
[CMO]B:148 |
1 |
1 |
137 |
f |
[HEM]B:147 |
x,y,z |
1_555 |
17 |
1 |
833 |
43.8 |
-2.1 |
0.707 |
0 |
0 |
0 |
0.035 |
24 |
34 |
|
A |
3 |
1 |
7741 |
◊ |
C |
x,y,z-1 |
1_554 |
2 |
1 |
7688 |
7.9 |
0.2 |
0.718 |
0 |
0 |
0 |
0.000 |
25 |
35 |
|
D |
1 |
1 |
7697 |
◊ |
B |
x-1,y+1,z |
1_465 |
1 |
1 |
7548 |
1.5 |
0.0 |
0.729 |
0 |
0 |
0 |
0.000 |
26 |
36 |
|
[HEM]D:147 |
1 |
1 |
844 |
◊ |
[HEM]C:147 |
x,y,z |
1_555 |
1 |
1 |
835 |
0.3 |
-0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
|