## |
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 |
637 |
157 |
33523 |
◊ |
C |
x,y,z |
1_555 |
639 |
157 |
33458 |
5876.8 |
-38.1 |
0.271 |
94 |
44 |
0 |
0.680 |
2 |
|
B |
633 |
158 |
33188 |
◊ |
A |
x,y,z |
1_555 |
637 |
158 |
33453 |
5864.5 |
-35.8 |
0.345 |
92 |
44 |
0 |
0.680 |
Average: |
5870.7 |
-37.0 |
0.308 |
93 |
44 |
0 |
0.680 |
2 |
3 |
|
C |
621 |
140 |
33458 |
◊ |
A |
x,y,z |
1_555 |
623 |
140 |
33453 |
5604.5 |
-58.5 |
0.023 |
74 |
4 |
0 |
0.711 |
4 |
|
D |
602 |
139 |
33523 |
◊ |
B |
x,y,z |
1_555 |
609 |
138 |
33188 |
5546.9 |
-58.7 |
0.020 |
74 |
5 |
0 |
0.711 |
Average: |
5575.7 |
-58.6 |
0.021 |
74 |
5 |
0 |
0.711 |
3 |
5 |
|
C |
229 |
66 |
33458 |
◊ |
B |
x,y,z |
1_555 |
229 |
66 |
33188 |
1998.8 |
-10.6 |
0.484 |
36 |
6 |
0 |
0.428 |
6 |
|
D |
229 |
65 |
33523 |
◊ |
A |
x,y,z |
1_555 |
225 |
66 |
33453 |
1962.9 |
-12.6 |
0.386 |
33 |
5 |
0 |
0.428 |
Average: |
1980.9 |
-11.6 |
0.435 |
35 |
6 |
0 |
0.428 |
4 |
7 |
|
A |
93 |
27 |
33453 |
◊ |
B |
x-1,y,z |
1_455 |
89 |
35 |
33188 |
815.7 |
-2.9 |
0.604 |
2 |
1 |
0 |
0.000 |
5 |
8 |
|
[HEM]B:801 |
43 |
1 |
807 |
f |
B |
x,y,z |
1_555 |
97 |
29 |
33188 |
576.8 |
-18.2 |
0.621 |
4 |
0 |
0 |
0.589 |
9 |
|
[HEM]D:801 |
43 |
1 |
795 |
f |
D |
x,y,z |
1_555 |
94 |
28 |
33523 |
571.6 |
-15.8 |
0.680 |
4 |
0 |
0 |
0.589 |
10 |
|
[HEM]C:801 |
43 |
1 |
792 |
f |
C |
x,y,z |
1_555 |
95 |
28 |
33458 |
568.5 |
-17.6 |
0.613 |
4 |
0 |
0 |
0.589 |
11 |
|
[HEM]A:801 |
43 |
1 |
792 |
f |
A |
x,y,z |
1_555 |
93 |
28 |
33453 |
566.5 |
-17.3 |
0.615 |
6 |
0 |
0 |
0.589 |
Average: |
570.8 |
-17.2 |
0.632 |
5 |
0 |
0 |
0.589 |
6 |
12 |
|
C |
51 |
17 |
33458 |
◊ |
D |
x-1,y,z |
1_455 |
63 |
22 |
33523 |
477.5 |
-1.1 |
0.676 |
2 |
0 |
0 |
0.000 |
7 |
13 |
|
C |
53 |
21 |
33458 |
◊ |
A |
x-1,y-1,z-1 |
1_444 |
47 |
17 |
33453 |
427.3 |
-2.9 |
0.455 |
1 |
0 |
0 |
0.000 |
8 |
14 |
|
C |
46 |
17 |
33458 |
◊ |
D |
x,y-1,z |
1_545 |
53 |
14 |
33523 |
392.7 |
-3.7 |
0.251 |
0 |
1 |
0 |
0.000 |
15 |
|
B |
48 |
11 |
33188 |
◊ |
A |
x,y-1,z |
1_545 |
44 |
16 |
33453 |
348.2 |
-3.8 |
0.300 |
0 |
1 |
0 |
0.000 |
Average: |
370.5 |
-3.8 |
0.275 |
0 |
1 |
0 |
0.000 |
9 |
16 |
|
C |
41 |
11 |
33458 |
◊ |
A |
x,y-1,z |
1_545 |
41 |
9 |
33453 |
330.1 |
1.1 |
0.799 |
2 |
2 |
0 |
0.000 |
10 |
17 |
|
C |
21 |
7 |
33458 |
◊ |
B |
x-1,y-1,z-1 |
1_444 |
29 |
10 |
33188 |
201.7 |
1.1 |
0.800 |
2 |
1 |
0 |
0.000 |
11 |
18 |
|
D |
20 |
7 |
33523 |
◊ |
B |
x,y,z-1 |
1_554 |
17 |
4 |
33188 |
184.9 |
-0.8 |
0.469 |
1 |
0 |
0 |
0.000 |
12 |
19 |
|
D |
26 |
12 |
33523 |
◊ |
B |
x-1,y,z-1 |
1_454 |
16 |
5 |
33188 |
184.0 |
-0.2 |
0.661 |
1 |
1 |
0 |
0.000 |
13 |
20 |
|
C |
19 |
7 |
33458 |
◊ |
B |
x-1,y,z |
1_455 |
17 |
5 |
33188 |
159.3 |
-0.5 |
0.608 |
0 |
0 |
0 |
0.000 |
14 |
21 |
|
C |
20 |
9 |
33458 |
◊ |
B |
x-1,y,z-1 |
1_454 |
16 |
6 |
33188 |
130.7 |
1.6 |
0.849 |
1 |
1 |
0 |
0.000 |
15 |
22 |
|
C |
8 |
4 |
33458 |
◊ |
A |
x,y-1,z-1 |
1_544 |
9 |
5 |
33453 |
75.2 |
-0.1 |
0.569 |
1 |
0 |
0 |
0.000 |
16 |
23 |
|
[HEM]A:801 |
7 |
1 |
792 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
33188 |
75.0 |
-2.1 |
0.470 |
0 |
0 |
0 |
0.032 |
24 |
|
[HEM]B:801 |
7 |
1 |
807 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
33453 |
72.0 |
-2.0 |
0.482 |
0 |
0 |
0 |
0.032 |
25 |
|
[HEM]C:801 |
8 |
1 |
792 |
◊ |
D |
x,y,z |
1_555 |
10 |
3 |
33523 |
70.9 |
-1.9 |
0.490 |
0 |
0 |
0 |
0.032 |
26 |
|
[HEM]D:801 |
7 |
1 |
795 |
◊ |
C |
x,y,z |
1_555 |
10 |
3 |
33458 |
68.6 |
-1.9 |
0.497 |
0 |
0 |
0 |
0.032 |
Average: |
71.6 |
-2.0 |
0.485 |
0 |
0 |
0 |
0.032 |
17 |
27 |
|
B |
5 |
2 |
33188 |
x |
B |
x,y-1,z |
1_545 |
6 |
2 |
33188 |
39.1 |
-0.1 |
0.541 |
0 |
0 |
0 |
0.000 |
28 |
|
D |
5 |
1 |
33523 |
x |
D |
x,y-1,z |
1_545 |
3 |
1 |
33523 |
23.1 |
-0.1 |
0.568 |
0 |
0 |
0 |
0.000 |
Average: |
31.1 |
-0.1 |
0.554 |
0 |
0 |
0 |
0.000 |
18 |
29 |
|
D |
8 |
4 |
33523 |
◊ |
A |
x-1,y-1,z-1 |
1_444 |
6 |
4 |
33453 |
37.8 |
0.5 |
0.772 |
0 |
0 |
0 |
0.000 |
19 |
30 |
|
D |
3 |
1 |
33523 |
◊ |
A |
x,y-1,z |
1_545 |
5 |
2 |
33453 |
35.6 |
0.4 |
0.762 |
1 |
2 |
0 |
0.000 |
31 |
|
C |
4 |
2 |
33458 |
◊ |
B |
x,y-1,z |
1_545 |
3 |
1 |
33188 |
34.5 |
0.4 |
0.772 |
2 |
2 |
0 |
0.000 |
Average: |
35.1 |
0.4 |
0.767 |
2 |
2 |
0 |
0.000 |
20 |
32 |
|
A |
3 |
2 |
33453 |
x |
A |
x,y-1,z |
1_545 |
5 |
2 |
33453 |
15.9 |
-0.3 |
0.498 |
0 |
0 |
0 |
0.000 |
33 |
|
C |
4 |
2 |
33458 |
x |
C |
x,y-1,z |
1_545 |
3 |
2 |
33458 |
13.2 |
-0.2 |
0.501 |
0 |
0 |
0 |
0.000 |
Average: |
14.6 |
-0.3 |
0.500 |
0 |
0 |
0 |
0.000 |
21 |
34 |
|
D |
3 |
1 |
33523 |
◊ |
A |
x,y,z-1 |
1_554 |
3 |
2 |
33453 |
8.0 |
0.1 |
0.675 |
0 |
0 |
0 |
0.000 |
22 |
35 |
|
D |
2 |
1 |
33523 |
◊ |
A |
x-1,y,z-1 |
1_454 |
1 |
1 |
33453 |
2.2 |
-0.0 |
0.501 |
0 |
0 |
0 |
0.000 |
|