## |
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 |
219 |
68 |
13076 |
◊ |
C |
x,y,z |
1_555 |
214 |
66 |
13157 |
2184.2 |
-35.4 |
0.002 |
17 |
8 |
0 |
0.419 |
2 |
|
B |
220 |
68 |
13143 |
◊ |
A |
x,y,z |
1_555 |
220 |
68 |
13070 |
2181.4 |
-35.2 |
0.002 |
18 |
8 |
0 |
0.419 |
Average: |
2182.8 |
-35.3 |
0.002 |
18 |
8 |
0 |
0.419 |
2 |
3 |
|
A |
103 |
31 |
13070 |
◊ |
C |
x-1,y,z |
1_455 |
111 |
34 |
13157 |
945.6 |
-2.4 |
0.685 |
11 |
4 |
0 |
0.000 |
3 |
4 |
|
D |
61 |
16 |
13076 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
71 |
20 |
13143 |
583.3 |
-2.5 |
0.544 |
5 |
2 |
0 |
0.000 |
5 |
|
D |
64 |
19 |
13076 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
62 |
17 |
13143 |
559.6 |
-1.9 |
0.582 |
6 |
3 |
0 |
0.000 |
Average: |
571.4 |
-2.2 |
0.563 |
6 |
3 |
0 |
0.000 |
4 |
6 |
|
[ATP]D:301 |
31 |
1 |
644 |
f |
D |
x,y,z |
1_555 |
70 |
25 |
13076 |
425.2 |
-5.2 |
0.456 |
17 |
0 |
0 |
0.236 |
7 |
|
[ATP]B:301 |
31 |
1 |
647 |
f |
B |
x,y,z |
1_555 |
70 |
25 |
13143 |
423.5 |
-5.4 |
0.449 |
17 |
0 |
0 |
0.236 |
8 |
|
[ATP]C:301 |
31 |
1 |
642 |
f |
C |
x,y,z |
1_555 |
71 |
24 |
13157 |
404.9 |
-5.2 |
0.444 |
16 |
0 |
0 |
0.236 |
9 |
|
[ATP]A:301 |
31 |
1 |
643 |
f |
A |
x,y,z |
1_555 |
68 |
23 |
13070 |
400.7 |
-5.1 |
0.453 |
15 |
0 |
0 |
0.236 |
Average: |
413.6 |
-5.2 |
0.451 |
16 |
0 |
0 |
0.236 |
5 |
10 |
|
A |
36 |
11 |
13070 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
36 |
10 |
13143 |
327.5 |
-2.2 |
0.354 |
1 |
0 |
0 |
0.000 |
6 |
11 |
|
[N7G]D:303 |
18 |
1 |
566 |
f |
C |
x,y,z |
1_555 |
45 |
15 |
13157 |
287.0 |
-3.1 |
0.575 |
4 |
0 |
0 |
0.084 |
12 |
|
[N7G]D:302 |
18 |
1 |
571 |
f |
D |
x,y,z |
1_555 |
45 |
14 |
13076 |
286.2 |
-2.8 |
0.580 |
3 |
0 |
0 |
0.084 |
13 |
|
[N7G]B:303 |
18 |
1 |
569 |
f |
B |
x,y,z |
1_555 |
45 |
14 |
13143 |
285.7 |
-3.1 |
0.580 |
3 |
0 |
0 |
0.084 |
14 |
|
[N7G]B:302 |
18 |
1 |
567 |
f |
A |
x,y,z |
1_555 |
45 |
14 |
13070 |
283.1 |
-2.6 |
0.598 |
3 |
0 |
0 |
0.084 |
Average: |
285.5 |
-2.9 |
0.583 |
3 |
0 |
0 |
0.084 |
7 |
15 |
|
C |
25 |
8 |
13157 |
◊ |
B |
-x+3/2,-y,z-1/2 |
2_654 |
30 |
10 |
13143 |
252.5 |
0.3 |
0.686 |
4 |
1 |
0 |
0.000 |
16 |
|
D |
29 |
9 |
13076 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
28 |
8 |
13070 |
213.2 |
-1.4 |
0.491 |
1 |
0 |
0 |
0.000 |
Average: |
232.9 |
-0.5 |
0.588 |
3 |
1 |
0 |
0.000 |
8 |
17 |
|
C |
19 |
7 |
13157 |
◊ |
A |
x,y,z |
1_555 |
27 |
8 |
13070 |
187.3 |
-2.6 |
0.313 |
0 |
1 |
0 |
0.000 |
9 |
18 |
|
[N7G]B:303 |
14 |
1 |
569 |
◊ |
A |
x,y,z |
1_555 |
30 |
12 |
13070 |
176.1 |
-3.2 |
0.587 |
2 |
0 |
0 |
0.081 |
19 |
|
[N7G]D:302 |
15 |
1 |
571 |
◊ |
C |
x,y,z |
1_555 |
30 |
12 |
13157 |
175.9 |
-3.1 |
0.593 |
2 |
0 |
0 |
0.081 |
20 |
|
[N7G]D:303 |
15 |
1 |
566 |
◊ |
D |
x,y,z |
1_555 |
30 |
12 |
13076 |
174.3 |
-3.1 |
0.594 |
2 |
0 |
0 |
0.081 |
21 |
|
[N7G]B:302 |
14 |
1 |
567 |
◊ |
B |
x,y,z |
1_555 |
30 |
12 |
13143 |
172.8 |
-3.2 |
0.570 |
3 |
0 |
0 |
0.081 |
Average: |
174.8 |
-3.2 |
0.586 |
2 |
0 |
0 |
0.081 |
10 |
22 |
|
A |
13 |
5 |
13070 |
◊ |
B |
x-1,y,z |
1_455 |
16 |
6 |
13143 |
112.0 |
0.8 |
0.759 |
3 |
0 |
0 |
0.000 |
23 |
|
D |
13 |
6 |
13076 |
◊ |
C |
x-1,y,z |
1_455 |
11 |
3 |
13157 |
94.5 |
-0.1 |
0.618 |
1 |
0 |
0 |
0.000 |
Average: |
103.3 |
0.4 |
0.688 |
2 |
0 |
0 |
0.000 |
11 |
24 |
|
B |
19 |
7 |
13143 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
19 |
6 |
13143 |
109.7 |
0.4 |
0.677 |
0 |
0 |
0 |
0.000 |
12 |
25 |
|
D |
12 |
4 |
13076 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
9 |
3 |
13070 |
103.9 |
0.2 |
0.633 |
0 |
0 |
0 |
0.000 |
13 |
26 |
|
A |
10 |
3 |
13070 |
x |
A |
x-1,y,z |
1_455 |
8 |
3 |
13070 |
66.1 |
-0.1 |
0.593 |
1 |
1 |
0 |
0.000 |
27 |
|
C |
6 |
3 |
13157 |
x |
C |
x-1,y,z |
1_455 |
6 |
3 |
13157 |
25.3 |
-0.4 |
0.491 |
0 |
0 |
0 |
0.000 |
Average: |
45.7 |
-0.3 |
0.542 |
1 |
1 |
0 |
0.000 |
14 |
28 |
|
[MG]D:304 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
13076 |
52.1 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.093 |
29 |
|
[MG]B:304 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
13143 |
51.5 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.093 |
30 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
13070 |
50.8 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.093 |
31 |
|
[MG]C:302 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
13157 |
50.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.093 |
Average: |
51.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.093 |
15 |
32 |
|
[N7G]B:302 |
3 |
1 |
567 |
◊ |
[ATP]B:301 |
x,y,z |
1_555 |
4 |
1 |
647 |
41.9 |
0.4 |
0.668 |
1 |
0 |
0 |
0.001 |
33 |
|
[N7G]D:303 |
3 |
1 |
566 |
◊ |
[ATP]D:301 |
x,y,z |
1_555 |
4 |
1 |
644 |
40.8 |
0.4 |
0.668 |
1 |
0 |
0 |
0.001 |
34 |
|
[N7G]B:303 |
3 |
1 |
569 |
◊ |
[ATP]A:301 |
x,y,z |
1_555 |
4 |
1 |
643 |
40.3 |
0.4 |
0.676 |
1 |
0 |
0 |
0.001 |
35 |
|
[N7G]D:302 |
3 |
1 |
571 |
◊ |
[ATP]C:301 |
x,y,z |
1_555 |
4 |
1 |
642 |
39.7 |
0.4 |
0.664 |
1 |
0 |
0 |
0.001 |
Average: |
40.7 |
0.4 |
0.669 |
1 |
0 |
0 |
0.001 |
16 |
36 |
|
[ATP]A:301 |
2 |
1 |
643 |
◊ |
C |
x-1,y,z |
1_455 |
6 |
2 |
13157 |
36.6 |
1.0 |
0.779 |
1 |
0 |
0 |
0.000 |
37 |
|
A |
5 |
2 |
13070 |
◊ |
[ATP]C:301 |
x-1,y,z |
1_455 |
3 |
1 |
642 |
35.2 |
0.9 |
0.747 |
0 |
0 |
0 |
0.000 |
Average: |
35.9 |
0.9 |
0.763 |
1 |
0 |
0 |
0.000 |
17 |
38 |
|
[MG]D:304 |
1 |
1 |
98 |
f |
[ATP]D:301 |
x,y,z |
1_555 |
3 |
1 |
644 |
34.8 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.088 |
39 |
|
[MG]B:304 |
1 |
1 |
98 |
f |
[ATP]B:301 |
x,y,z |
1_555 |
4 |
1 |
647 |
34.7 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.088 |
40 |
|
[MG]A:302 |
1 |
1 |
98 |
f |
[ATP]A:301 |
x,y,z |
1_555 |
4 |
1 |
643 |
34.1 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.088 |
41 |
|
[MG]C:302 |
1 |
1 |
98 |
f |
[ATP]C:301 |
x,y,z |
1_555 |
3 |
1 |
642 |
33.7 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.088 |
Average: |
34.3 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.088 |
18 |
42 |
|
[ATP]D:301 |
3 |
1 |
644 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
13157 |
30.5 |
0.1 |
0.260 |
0 |
0 |
0 |
0.000 |
43 |
|
[ATP]B:301 |
3 |
1 |
647 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
13070 |
30.0 |
0.1 |
0.261 |
0 |
0 |
0 |
0.000 |
44 |
|
[ATP]C:301 |
3 |
1 |
642 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
13076 |
29.9 |
0.1 |
0.258 |
0 |
0 |
0 |
0.000 |
45 |
|
[ATP]A:301 |
3 |
1 |
643 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
13143 |
29.9 |
0.0 |
0.250 |
0 |
0 |
0 |
0.000 |
Average: |
30.1 |
0.1 |
0.257 |
0 |
0 |
0 |
0.000 |
19 |
46 |
|
D |
1 |
1 |
13076 |
x |
D |
x-1/2,-y-1/2,-z-1 |
4_444 |
1 |
1 |
13076 |
4.5 |
0.2 |
0.819 |
0 |
0 |
0 |
0.000 |
20 |
47 |
|
[N7G]D:302 |
1 |
1 |
571 |
◊ |
[MG]C:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.4 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.007 |
48 |
|
[N7G]B:303 |
1 |
1 |
569 |
◊ |
[MG]A:302 |
x,y,z |
1_555 |
1 |
1 |
98 |
3.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.007 |
49 |
|
[N7G]B:302 |
1 |
1 |
567 |
◊ |
[MG]B:304 |
x,y,z |
1_555 |
1 |
1 |
98 |
3.4 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.007 |
50 |
|
[N7G]D:303 |
1 |
1 |
566 |
◊ |
[MG]D:304 |
x,y,z |
1_555 |
1 |
1 |
98 |
2.5 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.007 |
Average: |
3.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.007 |
|