## |
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 |
|
F |
105 |
11 |
4010 |
◊ |
B |
x,y,z |
1_555 |
116 |
38 |
17813 |
946.5 |
-15.2 |
0.428 |
18 |
0 |
0 |
0.251 |
2 |
2 |
|
D |
100 |
10 |
4010 |
◊ |
A |
x,y,z |
1_555 |
100 |
35 |
17918 |
930.0 |
-12.5 |
0.452 |
16 |
0 |
0 |
0.442 |
3 |
3 |
|
F |
80 |
13 |
4010 |
◊ |
E |
x,y,z |
1_555 |
62 |
14 |
3307 |
660.2 |
-5.3 |
0.711 |
41 |
0 |
0 |
1.000 |
4 |
4 |
|
E |
78 |
10 |
3307 |
◊ |
B |
x,y,z |
1_555 |
82 |
33 |
17813 |
657.5 |
-12.6 |
0.205 |
14 |
0 |
0 |
0.203 |
5 |
5 |
|
D |
68 |
13 |
4010 |
◊ |
C |
x,y,z |
1_555 |
57 |
14 |
3271 |
585.2 |
-8.0 |
0.604 |
40 |
0 |
0 |
1.000 |
6 |
6 |
|
C |
67 |
10 |
3271 |
◊ |
A |
x,y,z |
1_555 |
71 |
26 |
17918 |
556.8 |
-13.3 |
0.217 |
14 |
0 |
0 |
0.455 |
7 |
7 |
|
[ATP]A:1803 |
28 |
1 |
575 |
f |
A |
x,y,z |
1_555 |
47 |
21 |
17918 |
302.5 |
0.3 |
0.491 |
10 |
0 |
0 |
0.097 |
8 |
|
[ATP]B:1804 |
26 |
1 |
574 |
f |
B |
x,y,z |
1_555 |
45 |
20 |
17813 |
283.9 |
0.3 |
0.506 |
10 |
0 |
0 |
0.097 |
Average: |
293.2 |
0.3 |
0.498 |
10 |
0 |
0 |
0.097 |
8 |
9 |
|
A |
27 |
9 |
17918 |
◊ |
B |
-x+1,y-1/2,-z+3/2 |
3_646 |
27 |
9 |
17813 |
289.0 |
-4.1 |
0.146 |
2 |
0 |
0 |
0.000 |
9 |
10 |
|
A |
28 |
10 |
17918 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
33 |
9 |
17813 |
282.0 |
-4.3 |
0.154 |
2 |
0 |
0 |
0.000 |
10 |
11 |
|
B |
32 |
9 |
17813 |
x |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
29 |
8 |
17813 |
251.9 |
-0.3 |
0.540 |
4 |
5 |
0 |
0.000 |
12 |
|
A |
25 |
8 |
17918 |
x |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
28 |
10 |
17918 |
228.7 |
2.2 |
0.758 |
7 |
5 |
0 |
0.000 |
Average: |
240.3 |
1.0 |
0.649 |
6 |
5 |
0 |
0.000 |
11 |
13 |
|
A |
30 |
9 |
17918 |
◊ |
F |
x,y-1,z |
1_545 |
29 |
3 |
4010 |
248.1 |
0.7 |
0.710 |
1 |
0 |
0 |
0.000 |
12 |
14 |
|
D |
25 |
4 |
4010 |
◊ |
B |
x,y,z |
1_555 |
30 |
9 |
17813 |
233.5 |
1.3 |
0.730 |
1 |
0 |
0 |
0.000 |
13 |
15 |
|
A |
21 |
7 |
17918 |
◊ |
E |
x,y-1,z |
1_545 |
20 |
2 |
3307 |
198.2 |
0.4 |
0.591 |
2 |
0 |
0 |
0.000 |
14 |
16 |
|
C |
19 |
2 |
3271 |
◊ |
B |
x,y,z |
1_555 |
22 |
7 |
17813 |
196.7 |
0.7 |
0.631 |
2 |
0 |
0 |
0.000 |
15 |
17 |
|
A |
22 |
5 |
17918 |
x |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
26 |
10 |
17918 |
187.3 |
-0.4 |
0.493 |
2 |
0 |
0 |
0.000 |
16 |
18 |
|
B |
17 |
5 |
17813 |
x |
B |
-x+1,y-1/2,-z+3/2 |
3_646 |
24 |
10 |
17813 |
164.4 |
-0.4 |
0.477 |
2 |
0 |
0 |
0.000 |
17 |
19 |
|
[3DR]F:1906 |
11 |
1 |
313 |
◊ |
B |
x,y,z |
1_555 |
27 |
9 |
17813 |
154.7 |
-0.9 |
0.455 |
4 |
0 |
0 |
0.029 |
18 |
20 |
|
[3DR]D:1906 |
11 |
1 |
314 |
◊ |
A |
x,y,z |
1_555 |
21 |
9 |
17918 |
149.0 |
-1.1 |
0.442 |
3 |
0 |
0 |
0.054 |
19 |
21 |
|
D |
19 |
3 |
4010 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
15 |
4 |
17813 |
148.9 |
1.5 |
0.789 |
2 |
0 |
0 |
0.000 |
20 |
22 |
|
[3DR]D:1906 |
11 |
1 |
314 |
cf |
D |
x,y,z |
1_555 |
14 |
2 |
4010 |
136.3 |
1.6 |
0.669 |
0 |
0 |
0 |
0.000 |
21 |
23 |
|
[3DR]F:1906 |
10 |
1 |
313 |
cf |
F |
x,y,z |
1_555 |
14 |
2 |
4010 |
129.4 |
1.4 |
0.676 |
0 |
0 |
0 |
0.000 |
22 |
24 |
|
B |
14 |
5 |
17813 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
17 |
6 |
17918 |
125.6 |
4.4 |
0.911 |
0 |
6 |
0 |
0.000 |
23 |
25 |
|
[ATP]B:1804 |
18 |
1 |
574 |
◊ |
E |
x,y,z |
1_555 |
17 |
1 |
3307 |
113.3 |
3.0 |
0.695 |
0 |
0 |
0 |
0.000 |
24 |
26 |
|
[ATP]A:1803 |
16 |
1 |
575 |
◊ |
C |
x,y,z |
1_555 |
17 |
1 |
3271 |
95.3 |
1.3 |
0.612 |
0 |
0 |
0 |
0.000 |
25 |
27 |
|
A |
9 |
5 |
17918 |
◊ |
F |
-x+3/2,-y+1,z-1/2 |
2_664 |
12 |
2 |
4010 |
64.9 |
1.3 |
0.779 |
0 |
0 |
0 |
0.000 |
26 |
28 |
|
D |
9 |
2 |
4010 |
◊ |
B |
-x+1,y-1/2,-z+3/2 |
3_646 |
5 |
2 |
17813 |
58.0 |
-1.2 |
0.535 |
0 |
0 |
0 |
0.000 |
27 |
29 |
|
[ATP]A:1803 |
4 |
1 |
575 |
◊ |
D |
x,y,z |
1_555 |
5 |
1 |
4010 |
48.0 |
-0.6 |
0.411 |
1 |
0 |
0 |
0.024 |
28 |
30 |
|
[ATP]B:1804 |
3 |
1 |
574 |
◊ |
F |
x,y,z |
1_555 |
5 |
1 |
4010 |
46.9 |
-0.8 |
0.414 |
1 |
0 |
0 |
0.013 |
29 |
31 |
|
[MG]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
17918 |
36.7 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.108 |
30 |
32 |
|
A |
3 |
2 |
17918 |
◊ |
F |
-x+1,y-1/2,-z+1/2 |
3_645 |
6 |
1 |
4010 |
33.4 |
-1.4 |
0.468 |
0 |
0 |
0 |
0.000 |
31 |
33 |
|
[MG]B:404 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
17813 |
31.5 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.112 |
34 |
|
[MG]A:402 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
7 |
17918 |
31.3 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.112 |
Average: |
31.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.112 |
32 |
35 |
|
[ATP]A:1803 |
7 |
1 |
575 |
f |
[MG]A:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.3 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.097 |
36 |
|
[ATP]B:1804 |
6 |
1 |
574 |
f |
[MG]B:404 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.6 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.097 |
Average: |
31.0 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.097 |
33 |
37 |
|
B |
3 |
1 |
17813 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
17918 |
30.1 |
0.8 |
0.706 |
0 |
0 |
0 |
0.000 |
38 |
|
A |
1 |
1 |
17918 |
◊ |
B |
x,y-1,z |
1_545 |
1 |
1 |
17813 |
14.0 |
0.7 |
0.894 |
0 |
0 |
0 |
0.000 |
Average: |
22.1 |
0.7 |
0.800 |
0 |
0 |
0 |
0.000 |
34 |
39 |
|
[ATP]A:1803 |
6 |
1 |
575 |
f |
[MG]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.5 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.081 |
35 |
40 |
|
D |
3 |
1 |
4010 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
17918 |
26.3 |
-0.8 |
0.499 |
1 |
0 |
0 |
0.000 |
36 |
41 |
|
[CA]B:403 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
17813 |
24.4 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.059 |
37 |
42 |
|
[CA]B:403 |
1 |
1 |
85 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
3307 |
21.7 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.043 |
38 |
43 |
|
[CA]B:403 |
1 |
1 |
85 |
f |
[ATP]B:1804 |
x,y,z |
1_555 |
3 |
1 |
574 |
20.4 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.040 |
39 |
44 |
|
[3DR]D:1906 |
2 |
1 |
314 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
3271 |
19.6 |
1.1 |
0.656 |
0 |
0 |
0 |
0.000 |
40 |
45 |
|
[3DR]F:1906 |
1 |
1 |
313 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
3307 |
14.6 |
1.0 |
0.742 |
0 |
0 |
0 |
0.000 |
41 |
46 |
|
A |
3 |
1 |
17918 |
◊ |
C |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
3271 |
14.4 |
-0.6 |
0.334 |
0 |
0 |
0 |
0.000 |
42 |
47 |
|
[3DR]D:1906 |
1 |
1 |
314 |
◊ |
[ATP]A:1803 |
x,y,z |
1_555 |
1 |
1 |
575 |
11.6 |
0.8 |
0.618 |
0 |
0 |
0 |
0.000 |
43 |
48 |
|
[MG]A:402 |
1 |
1 |
98 |
f |
[MG]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.4 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.053 |
44 |
49 |
|
[CA]B:403 |
1 |
1 |
85 |
f |
[MG]B:404 |
x,y,z |
1_555 |
1 |
1 |
98 |
9.9 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.027 |
45 |
50 |
|
[MG]A:401 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
3271 |
9.9 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.027 |
46 |
51 |
|
[3DR]F:1906 |
2 |
1 |
313 |
◊ |
[ATP]B:1804 |
x,y,z |
1_555 |
2 |
1 |
574 |
9.3 |
0.6 |
0.561 |
0 |
0 |
0 |
0.000 |
47 |
52 |
|
B |
1 |
1 |
17813 |
◊ |
F |
x-1/2,-y+3/2,-z+1 |
4_466 |
1 |
1 |
4010 |
8.0 |
-0.3 |
0.391 |
0 |
0 |
0 |
0.000 |
48 |
53 |
|
A |
2 |
1 |
17918 |
◊ |
B |
-x+3/2,-y+1,z-1/2 |
2_664 |
2 |
1 |
17813 |
6.6 |
0.2 |
0.708 |
0 |
0 |
0 |
0.000 |
49 |
54 |
|
A |
1 |
1 |
17918 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
1 |
1 |
17813 |
4.9 |
0.2 |
0.816 |
0 |
0 |
0 |
0.000 |
50 |
55 |
|
E |
1 |
1 |
3307 |
◊ |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
1 |
1 |
17813 |
2.3 |
0.1 |
0.424 |
0 |
0 |
0 |
0.000 |
51 |
56 |
|
[MG]B:404 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
3307 |
1.6 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.003 |
|