## |
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 |
|
E |
92 |
26 |
21734 |
◊ |
A |
x,y,z |
1_555 |
92 |
28 |
21751 |
874.2 |
-9.9 |
0.121 |
4 |
0 |
0 |
0.026 |
2 |
|
F |
89 |
27 |
21918 |
◊ |
B |
x,y,z |
1_555 |
86 |
26 |
21708 |
854.2 |
-10.9 |
0.097 |
4 |
0 |
0 |
0.026 |
3 |
|
G |
80 |
23 |
21380 |
◊ |
C |
x,y,z |
1_555 |
83 |
24 |
21618 |
825.9 |
-9.9 |
0.086 |
5 |
0 |
0 |
0.026 |
4 |
|
H |
83 |
24 |
21471 |
◊ |
D |
x,y,z |
1_555 |
81 |
25 |
21492 |
807.3 |
-10.6 |
0.102 |
5 |
0 |
0 |
0.026 |
Average: |
840.4 |
-10.3 |
0.101 |
5 |
0 |
0 |
0.026 |
2 |
5 |
|
G |
66 |
18 |
21380 |
◊ |
A |
x,y,z |
1_555 |
73 |
20 |
21751 |
652.8 |
-3.9 |
0.419 |
7 |
2 |
0 |
0.012 |
6 |
|
H |
62 |
18 |
21471 |
◊ |
B |
x,y,z |
1_555 |
69 |
19 |
21708 |
621.6 |
-3.9 |
0.453 |
7 |
1 |
0 |
0.012 |
7 |
|
E |
59 |
17 |
21734 |
◊ |
C |
x,y,z |
1_555 |
63 |
17 |
21618 |
561.4 |
-3.0 |
0.448 |
6 |
0 |
0 |
0.012 |
8 |
|
F |
48 |
16 |
21918 |
◊ |
D |
x,y,z |
1_555 |
53 |
16 |
21492 |
495.9 |
-3.9 |
0.377 |
6 |
0 |
0 |
0.012 |
Average: |
582.9 |
-3.7 |
0.424 |
7 |
1 |
0 |
0.012 |
3 |
9 |
|
B |
60 |
22 |
21708 |
◊ |
E |
x,y-1,z-1 |
1_544 |
72 |
24 |
21734 |
598.7 |
-5.1 |
0.305 |
3 |
3 |
0 |
0.000 |
10 |
|
F |
71 |
24 |
21918 |
◊ |
A |
x,y,z |
1_555 |
52 |
18 |
21751 |
564.6 |
-3.8 |
0.351 |
2 |
3 |
0 |
0.000 |
11 |
|
H |
49 |
17 |
21471 |
◊ |
C |
x,y-1,z |
1_545 |
53 |
19 |
21618 |
452.8 |
-1.9 |
0.562 |
2 |
2 |
0 |
0.000 |
12 |
|
D |
37 |
18 |
21492 |
◊ |
G |
x,y,z-1 |
1_554 |
39 |
17 |
21380 |
331.5 |
-0.4 |
0.649 |
1 |
2 |
0 |
0.000 |
Average: |
486.9 |
-2.8 |
0.467 |
2 |
3 |
0 |
0.000 |
4 |
13 |
|
[ATP]A:600 |
31 |
1 |
624 |
f |
A |
x,y,z |
1_555 |
66 |
24 |
21751 |
444.2 |
-1.6 |
0.638 |
13 |
0 |
0 |
0.046 |
14 |
|
[ATP]B:600 |
31 |
1 |
623 |
f |
B |
x,y,z |
1_555 |
66 |
24 |
21708 |
443.9 |
-0.7 |
0.676 |
16 |
0 |
0 |
0.046 |
15 |
|
[ATP]H:600 |
31 |
1 |
627 |
f |
H |
x,y,z |
1_555 |
67 |
23 |
21471 |
443.1 |
-1.4 |
0.662 |
17 |
0 |
0 |
0.046 |
16 |
|
[ATP]D:600 |
31 |
1 |
625 |
f |
D |
x,y,z |
1_555 |
67 |
23 |
21492 |
442.1 |
-0.8 |
0.683 |
13 |
0 |
0 |
0.046 |
17 |
|
[ATP]G:600 |
31 |
1 |
621 |
f |
G |
x,y,z |
1_555 |
64 |
24 |
21380 |
440.4 |
0.7 |
0.731 |
15 |
0 |
0 |
0.046 |
18 |
|
[ATP]E:600 |
30 |
1 |
622 |
f |
E |
x,y,z |
1_555 |
62 |
22 |
21734 |
438.9 |
-0.9 |
0.655 |
16 |
0 |
0 |
0.046 |
19 |
|
[ATP]C:600 |
31 |
1 |
623 |
f |
C |
x,y,z |
1_555 |
63 |
23 |
21618 |
436.4 |
-1.2 |
0.656 |
14 |
0 |
0 |
0.046 |
20 |
|
[ATP]F:600 |
30 |
1 |
614 |
f |
F |
x,y,z |
1_555 |
62 |
23 |
21918 |
432.1 |
-1.2 |
0.671 |
14 |
0 |
0 |
0.046 |
Average: |
440.1 |
-0.9 |
0.671 |
15 |
0 |
0 |
0.046 |
5 |
21 |
|
F |
51 |
19 |
21918 |
◊ |
E |
-x+1,y-1/2,-z+1 |
2_646 |
40 |
15 |
21734 |
337.4 |
-1.2 |
0.575 |
1 |
0 |
0 |
0.000 |
22 |
|
H |
43 |
15 |
21471 |
◊ |
G |
-x,y-1/2,-z+1 |
2_546 |
36 |
13 |
21380 |
319.7 |
-1.7 |
0.544 |
2 |
1 |
0 |
0.000 |
Average: |
328.6 |
-1.5 |
0.560 |
2 |
1 |
0 |
0.000 |
6 |
23 |
|
D |
28 |
9 |
21492 |
◊ |
B |
x,y,z |
1_555 |
31 |
13 |
21708 |
299.3 |
-1.9 |
0.440 |
2 |
4 |
0 |
0.005 |
24 |
|
C |
31 |
9 |
21618 |
◊ |
A |
x,y,z |
1_555 |
30 |
11 |
21751 |
289.2 |
-1.0 |
0.508 |
2 |
4 |
0 |
0.005 |
25 |
|
H |
29 |
11 |
21471 |
◊ |
F |
x,y,z |
1_555 |
27 |
9 |
21918 |
270.1 |
-1.5 |
0.525 |
2 |
4 |
0 |
0.005 |
26 |
|
G |
27 |
8 |
21380 |
◊ |
E |
x,y,z |
1_555 |
27 |
8 |
21734 |
267.5 |
-1.1 |
0.512 |
1 |
6 |
0 |
0.005 |
Average: |
281.5 |
-1.4 |
0.496 |
2 |
5 |
0 |
0.005 |
7 |
27 |
|
H |
23 |
8 |
21471 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
33 |
10 |
21492 |
252.9 |
-0.6 |
0.525 |
5 |
3 |
0 |
0.000 |
28 |
|
G |
22 |
8 |
21380 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
33 |
9 |
21618 |
239.6 |
-0.6 |
0.417 |
3 |
1 |
0 |
0.000 |
29 |
|
B |
35 |
10 |
21708 |
◊ |
F |
-x+1,y-1/2,-z |
2_645 |
21 |
7 |
21918 |
235.9 |
-0.3 |
0.653 |
3 |
0 |
0 |
0.000 |
30 |
|
A |
30 |
10 |
21751 |
◊ |
E |
-x+1,y-1/2,-z+1 |
2_646 |
28 |
9 |
21734 |
233.5 |
0.5 |
0.595 |
5 |
3 |
0 |
0.000 |
Average: |
240.5 |
-0.3 |
0.547 |
4 |
2 |
0 |
0.000 |
8 |
31 |
|
D |
27 |
7 |
21492 |
◊ |
E |
x,y,z-1 |
1_554 |
25 |
9 |
21734 |
214.5 |
-1.5 |
0.410 |
0 |
0 |
0 |
0.000 |
32 |
|
B |
28 |
7 |
21708 |
◊ |
G |
x,y-1,z-1 |
1_544 |
23 |
8 |
21380 |
207.9 |
-1.2 |
0.498 |
1 |
1 |
0 |
0.000 |
33 |
|
H |
24 |
7 |
21471 |
◊ |
A |
x,y,z |
1_555 |
29 |
7 |
21751 |
202.1 |
-1.6 |
0.473 |
1 |
0 |
0 |
0.000 |
34 |
|
F |
18 |
7 |
21918 |
◊ |
C |
x,y-1,z |
1_545 |
23 |
6 |
21618 |
179.7 |
-0.4 |
0.546 |
1 |
0 |
0 |
0.000 |
Average: |
201.0 |
-1.2 |
0.482 |
1 |
0 |
0 |
0.000 |
9 |
35 |
|
[MG]A:601 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
21751 |
37.3 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.034 |
36 |
|
[MG]E:601 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
11 |
6 |
21734 |
37.3 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.034 |
37 |
|
[MG]B:601 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
21708 |
36.9 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.034 |
38 |
|
[MG]F:601 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
9 |
5 |
21918 |
36.8 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.034 |
39 |
|
[MG]C:601 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
4 |
21618 |
35.8 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.034 |
40 |
|
[MG]D:601 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
21492 |
35.6 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.034 |
41 |
|
[MG]G:601 |
1 |
1 |
98 |
f |
G |
x,y,z |
1_555 |
8 |
5 |
21380 |
35.6 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.034 |
42 |
|
[MG]H:601 |
1 |
1 |
98 |
f |
H |
x,y,z |
1_555 |
6 |
3 |
21471 |
34.0 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.034 |
Average: |
36.2 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.034 |
10 |
43 |
|
[MG]C:601 |
1 |
1 |
98 |
f |
[ATP]C:600 |
x,y,z |
1_555 |
6 |
1 |
623 |
35.1 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.029 |
44 |
|
[MG]G:601 |
1 |
1 |
98 |
f |
[ATP]G:600 |
x,y,z |
1_555 |
7 |
1 |
621 |
35.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.029 |
45 |
|
[MG]E:601 |
1 |
1 |
98 |
f |
[ATP]E:600 |
x,y,z |
1_555 |
6 |
1 |
622 |
34.9 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.029 |
46 |
|
[MG]F:601 |
1 |
1 |
98 |
f |
[ATP]F:600 |
x,y,z |
1_555 |
5 |
1 |
614 |
34.8 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.029 |
47 |
|
[MG]A:601 |
1 |
1 |
98 |
f |
[ATP]A:600 |
x,y,z |
1_555 |
9 |
1 |
624 |
34.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.029 |
48 |
|
[MG]B:601 |
1 |
1 |
98 |
f |
[ATP]B:600 |
x,y,z |
1_555 |
4 |
1 |
623 |
34.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.029 |
49 |
|
[MG]D:601 |
1 |
1 |
98 |
f |
[ATP]D:600 |
x,y,z |
1_555 |
6 |
1 |
625 |
34.7 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.029 |
50 |
|
[MG]H:601 |
1 |
1 |
98 |
f |
[ATP]H:600 |
x,y,z |
1_555 |
8 |
1 |
627 |
34.4 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.029 |
Average: |
34.8 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.029 |
11 |
51 |
|
A |
2 |
1 |
21751 |
◊ |
C |
x,y-1,z |
1_545 |
2 |
1 |
21618 |
4.2 |
-0.0 |
0.571 |
0 |
0 |
0 |
0.000 |
|