## |
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 |
310 |
73 |
21674 |
◊ |
A |
x,y,z |
1_555 |
304 |
73 |
21938 |
3052.7 |
-28.4 |
0.046 |
37 |
23 |
0 |
0.824 |
2 |
|
D |
307 |
74 |
22003 |
◊ |
C |
x,y,z |
1_555 |
301 |
72 |
22036 |
3011.6 |
-28.6 |
0.055 |
35 |
28 |
0 |
0.824 |
Average: |
3032.2 |
-28.5 |
0.051 |
36 |
26 |
0 |
0.824 |
2 |
3 |
|
C |
120 |
36 |
22036 |
◊ |
A |
x,y,z |
1_555 |
118 |
37 |
21938 |
1000.4 |
2.0 |
0.773 |
10 |
8 |
0 |
0.063 |
4 |
|
D |
107 |
34 |
22003 |
◊ |
B |
x,y,z |
1_555 |
112 |
35 |
21674 |
972.5 |
1.4 |
0.758 |
10 |
11 |
0 |
0.063 |
Average: |
986.4 |
1.7 |
0.766 |
10 |
10 |
0 |
0.063 |
3 |
5 |
|
D |
46 |
18 |
22003 |
◊ |
B |
x-1,y,z |
1_455 |
42 |
18 |
21674 |
367.3 |
-0.8 |
0.596 |
0 |
2 |
0 |
0.000 |
6 |
|
C |
40 |
15 |
22036 |
◊ |
A |
x-1,y,z |
1_455 |
37 |
16 |
21938 |
356.8 |
-2.1 |
0.422 |
0 |
0 |
0 |
0.000 |
Average: |
362.0 |
-1.5 |
0.509 |
0 |
1 |
0 |
0.000 |
4 |
7 |
|
[NAD]A:502 |
32 |
1 |
750 |
◊ |
C |
x,y,z |
1_555 |
40 |
13 |
22036 |
332.8 |
-0.4 |
0.576 |
5 |
0 |
0 |
0.057 |
8 |
|
[NAD]C:502 |
29 |
1 |
745 |
◊ |
A |
x,y,z |
1_555 |
47 |
13 |
21938 |
331.5 |
-0.6 |
0.586 |
3 |
0 |
0 |
0.057 |
9 |
|
[NAD]B:601 |
31 |
1 |
748 |
◊ |
D |
x,y,z |
1_555 |
48 |
12 |
22003 |
329.8 |
-0.3 |
0.633 |
3 |
0 |
0 |
0.057 |
10 |
|
[NAD]B:602 |
30 |
1 |
747 |
◊ |
B |
x,y,z |
1_555 |
47 |
14 |
21674 |
329.6 |
-0.2 |
0.629 |
3 |
0 |
0 |
0.057 |
Average: |
330.9 |
-0.4 |
0.606 |
4 |
0 |
0 |
0.057 |
5 |
11 |
|
[NAD]A:502 |
35 |
1 |
750 |
f |
A |
x,y,z |
1_555 |
35 |
9 |
21938 |
310.1 |
-4.2 |
0.400 |
3 |
0 |
0 |
0.177 |
12 |
|
[NAD]B:601 |
36 |
1 |
748 |
f |
B |
x,y,z |
1_555 |
32 |
8 |
21674 |
301.2 |
-3.4 |
0.480 |
3 |
0 |
0 |
0.177 |
13 |
|
[NAD]C:502 |
34 |
1 |
745 |
f |
C |
x,y,z |
1_555 |
33 |
9 |
22036 |
295.8 |
-4.4 |
0.414 |
3 |
0 |
0 |
0.177 |
14 |
|
[NAD]B:602 |
35 |
1 |
747 |
f |
D |
x,y,z |
1_555 |
33 |
8 |
22003 |
294.5 |
-3.7 |
0.487 |
2 |
0 |
0 |
0.177 |
Average: |
300.4 |
-3.9 |
0.445 |
3 |
0 |
0 |
0.177 |
6 |
15 |
|
[NAD]D:501 |
33 |
1 |
769 |
◊ |
B |
x,y,z |
1_555 |
36 |
11 |
21674 |
278.3 |
-0.9 |
0.709 |
3 |
0 |
0 |
0.069 |
16 |
|
[NAD]C:501 |
31 |
1 |
771 |
◊ |
C |
x,y,z |
1_555 |
37 |
12 |
22036 |
273.7 |
-0.8 |
0.715 |
4 |
0 |
0 |
0.069 |
17 |
|
[NAD]A:501 |
32 |
1 |
770 |
◊ |
A |
x,y,z |
1_555 |
39 |
12 |
21938 |
272.2 |
-2.2 |
0.587 |
2 |
0 |
0 |
0.069 |
18 |
|
[NAD]D:502 |
32 |
1 |
763 |
◊ |
D |
x,y,z |
1_555 |
34 |
12 |
22003 |
269.0 |
-0.8 |
0.717 |
3 |
0 |
0 |
0.069 |
Average: |
273.3 |
-1.2 |
0.682 |
3 |
0 |
0 |
0.069 |
7 |
19 |
|
[NAD]A:501 |
26 |
1 |
770 |
◊ |
C |
x,y,z |
1_555 |
33 |
8 |
22036 |
251.9 |
1.5 |
0.797 |
1 |
0 |
0 |
0.000 |
20 |
|
[NAD]D:501 |
26 |
1 |
769 |
◊ |
D |
x,y,z |
1_555 |
29 |
8 |
22003 |
248.1 |
2.9 |
0.902 |
6 |
0 |
0 |
0.000 |
21 |
|
[NAD]C:501 |
25 |
1 |
771 |
◊ |
A |
x,y,z |
1_555 |
31 |
9 |
21938 |
239.4 |
2.9 |
0.878 |
2 |
0 |
0 |
0.000 |
22 |
|
[NAD]D:502 |
24 |
1 |
763 |
◊ |
B |
x,y,z |
1_555 |
28 |
8 |
21674 |
233.4 |
2.2 |
0.800 |
0 |
0 |
0 |
0.000 |
Average: |
243.2 |
2.4 |
0.844 |
2 |
0 |
0 |
0.000 |
8 |
23 |
|
A |
24 |
7 |
21938 |
◊ |
D |
x,y,z-1 |
1_554 |
27 |
8 |
22003 |
218.8 |
-0.2 |
0.496 |
2 |
0 |
0 |
0.000 |
9 |
24 |
|
C |
12 |
3 |
22036 |
◊ |
B |
x,y,z-1 |
1_554 |
8 |
3 |
21674 |
125.8 |
-0.9 |
0.327 |
0 |
0 |
0 |
0.000 |
10 |
25 |
|
C |
15 |
4 |
22036 |
◊ |
D |
x,y,z-1 |
1_554 |
11 |
4 |
22003 |
122.5 |
-0.6 |
0.498 |
0 |
0 |
0 |
0.000 |
26 |
|
A |
9 |
4 |
21938 |
◊ |
B |
x,y,z-1 |
1_554 |
18 |
6 |
21674 |
92.5 |
-0.1 |
0.579 |
0 |
0 |
0 |
0.000 |
Average: |
107.5 |
-0.4 |
0.538 |
0 |
0 |
0 |
0.000 |
11 |
27 |
|
A |
17 |
5 |
21938 |
x |
A |
-x,y-1/2,-z-1 |
2_544 |
15 |
4 |
21938 |
118.6 |
0.4 |
0.632 |
0 |
0 |
0 |
0.000 |
12 |
28 |
|
A |
10 |
4 |
21938 |
◊ |
B |
-x,y-1/2,-z-1 |
2_544 |
14 |
5 |
21674 |
101.2 |
0.5 |
0.683 |
1 |
2 |
0 |
0.000 |
13 |
29 |
|
[NAD]C:501 |
7 |
1 |
771 |
f |
[NAD]A:501 |
x,y,z |
1_555 |
7 |
1 |
770 |
75.1 |
-4.5 |
0.203 |
0 |
0 |
0 |
0.100 |
30 |
|
[NAD]D:502 |
7 |
1 |
763 |
f |
[NAD]D:501 |
x,y,z |
1_555 |
6 |
1 |
769 |
74.6 |
-4.9 |
0.148 |
0 |
0 |
0 |
0.100 |
Average: |
74.9 |
-4.7 |
0.175 |
0 |
0 |
0 |
0.100 |
14 |
31 |
|
[NAD]A:502 |
5 |
1 |
750 |
◊ |
[NAD]A:501 |
x,y,z |
1_555 |
4 |
1 |
770 |
33.4 |
0.4 |
0.657 |
0 |
0 |
0 |
0.000 |
32 |
|
[NAD]B:602 |
5 |
1 |
747 |
◊ |
[NAD]D:502 |
x,y,z |
1_555 |
6 |
1 |
763 |
32.4 |
0.1 |
0.595 |
0 |
0 |
0 |
0.000 |
33 |
|
[NAD]B:601 |
5 |
1 |
748 |
◊ |
[NAD]D:501 |
x,y,z |
1_555 |
4 |
1 |
769 |
31.5 |
0.2 |
0.631 |
0 |
0 |
0 |
0.000 |
34 |
|
[NAD]C:502 |
4 |
1 |
745 |
◊ |
[NAD]C:501 |
x,y,z |
1_555 |
2 |
1 |
771 |
26.9 |
0.6 |
0.722 |
0 |
0 |
0 |
0.000 |
Average: |
31.0 |
0.3 |
0.651 |
0 |
0 |
0 |
0.000 |
15 |
35 |
|
C |
2 |
2 |
22036 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
2 |
21674 |
2.7 |
0.2 |
0.747 |
0 |
0 |
0 |
0.000 |
|