## |
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 |
331 |
94 |
18067 |
◊ |
A |
x,y,z |
1_555 |
334 |
99 |
17538 |
3455.1 |
-60.2 |
0.105 |
8 |
3 |
0 |
0.297 |
2 |
2 |
|
[ATP]B:409 |
31 |
1 |
615 |
f |
B |
x,y,z |
1_555 |
44 |
18 |
18067 |
367.4 |
-2.5 |
0.641 |
5 |
0 |
0 |
0.022 |
3 |
3 |
|
[ATP]A:408 |
29 |
1 |
605 |
f |
A |
x,y,z |
1_555 |
48 |
16 |
17538 |
350.7 |
-2.9 |
0.623 |
3 |
0 |
0 |
0.020 |
4 |
4 |
|
B |
33 |
11 |
18067 |
x |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
37 |
9 |
18067 |
320.4 |
2.6 |
0.965 |
1 |
1 |
0 |
0.000 |
5 |
5 |
|
A |
30 |
10 |
17538 |
x |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
37 |
9 |
17538 |
306.9 |
1.8 |
0.950 |
2 |
0 |
0 |
0.000 |
6 |
6 |
|
[UMQ]A:407 |
24 |
1 |
695 |
f |
A |
x,y,z |
1_555 |
43 |
8 |
17538 |
261.6 |
-4.6 |
0.492 |
0 |
0 |
0 |
0.021 |
7 |
7 |
|
[UMQ]B:405 |
24 |
1 |
773 |
f |
B |
x,y,z |
1_555 |
44 |
7 |
18067 |
257.8 |
-6.2 |
0.627 |
0 |
0 |
0 |
0.029 |
8 |
8 |
|
[UMQ]A:405 |
18 |
1 |
805 |
f |
A |
x,y,z |
1_555 |
31 |
9 |
17538 |
249.6 |
-5.9 |
0.422 |
0 |
0 |
0 |
0.027 |
9 |
9 |
|
[UMQ]A:406 |
26 |
1 |
756 |
◊ |
A |
x,y,z |
1_555 |
29 |
8 |
17538 |
242.1 |
-5.6 |
0.424 |
0 |
0 |
0 |
0.026 |
10 |
10 |
|
[UMQ]B:406 |
26 |
1 |
755 |
◊ |
B |
x,y,z |
1_555 |
32 |
6 |
18067 |
234.8 |
-5.1 |
0.543 |
0 |
0 |
0 |
0.023 |
11 |
11 |
|
[UMQ]B:404 |
13 |
1 |
453 |
f |
B |
x,y,z |
1_555 |
42 |
12 |
18067 |
225.9 |
-7.0 |
0.709 |
0 |
0 |
0 |
0.032 |
12 |
12 |
|
[UMQ]A:403 |
11 |
1 |
408 |
f |
A |
x,y,z |
1_555 |
23 |
8 |
17538 |
161.1 |
-10.1 |
0.531 |
0 |
0 |
0 |
0.047 |
13 |
13 |
|
[1PE]A:409 |
13 |
1 |
478 |
◊ |
A |
x,y,z |
1_555 |
23 |
8 |
17538 |
159.7 |
0.2 |
0.762 |
1 |
0 |
0 |
0.001 |
14 |
14 |
|
[UMQ]B:407 |
7 |
1 |
286 |
f |
B |
x,y,z |
1_555 |
26 |
10 |
18067 |
143.0 |
-9.8 |
0.596 |
0 |
0 |
0 |
0.045 |
15 |
15 |
|
[1PE]A:409 |
8 |
1 |
478 |
f |
B |
x,y,z |
1_555 |
17 |
4 |
18067 |
104.9 |
-2.0 |
0.490 |
0 |
0 |
0 |
0.009 |
16 |
16 |
|
[UMQ]B:408 |
5 |
1 |
238 |
f |
B |
x,y,z |
1_555 |
16 |
6 |
18067 |
100.8 |
-5.7 |
0.590 |
0 |
0 |
0 |
0.026 |
17 |
17 |
|
[UMQ]A:404 |
7 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
17538 |
100.1 |
-4.5 |
0.556 |
0 |
0 |
0 |
0.021 |
18 |
18 |
|
[UMQ]A:406 |
10 |
1 |
756 |
◊ |
[UMQ]A:405 |
x,y,z |
1_555 |
10 |
1 |
805 |
95.6 |
0.0 |
0.764 |
0 |
0 |
0 |
0.000 |
19 |
19 |
|
[SO4]B:403 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
18067 |
89.5 |
-14.7 |
0.852 |
5 |
0 |
0 |
0.078 |
20 |
20 |
|
[ATP]A:408 |
8 |
1 |
605 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
18067 |
88.5 |
0.5 |
0.662 |
0 |
0 |
0 |
0.000 |
21 |
21 |
|
[SO4]A:402 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
17538 |
86.9 |
-14.5 |
0.769 |
3 |
0 |
0 |
0.073 |
22 |
22 |
|
[UMQ]B:405 |
7 |
1 |
773 |
◊ |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
13 |
4 |
18067 |
79.1 |
0.5 |
0.826 |
0 |
0 |
0 |
0.000 |
23 |
23 |
|
[ATP]B:409 |
7 |
1 |
615 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
17538 |
75.5 |
0.9 |
0.691 |
0 |
0 |
0 |
0.000 |
24 |
24 |
|
[UMQ]A:407 |
10 |
1 |
695 |
f |
[UMQ]A:404 |
x,y,z |
1_555 |
5 |
1 |
295 |
71.5 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.010 |
25 |
25 |
|
[UMQ]B:405 |
5 |
1 |
773 |
f |
[UMQ]B:404 |
x,y,z |
1_555 |
4 |
1 |
453 |
60.0 |
-3.5 |
0.348 |
0 |
0 |
0 |
0.016 |
26 |
26 |
|
[UMQ]A:407 |
5 |
1 |
695 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
7 |
4 |
17538 |
58.0 |
0.6 |
0.762 |
1 |
0 |
0 |
0.000 |
27 |
27 |
|
[UMQ]A:406 |
3 |
1 |
756 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
18067 |
54.0 |
-5.6 |
0.175 |
0 |
0 |
0 |
0.026 |
28 |
28 |
|
[UMQ]B:406 |
3 |
1 |
755 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
17538 |
53.0 |
-6.4 |
0.166 |
0 |
0 |
0 |
0.029 |
29 |
29 |
|
[SO4]A:402 |
4 |
1 |
184 |
◊ |
A |
-x+2,y-1/2,-z+1/2 |
3_745 |
9 |
2 |
17538 |
50.6 |
-5.8 |
0.934 |
0 |
0 |
0 |
0.000 |
30 |
30 |
|
[SO4]B:403 |
5 |
1 |
186 |
◊ |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
7 |
3 |
18067 |
48.3 |
-5.8 |
0.936 |
0 |
0 |
0 |
0.000 |
31 |
31 |
|
[ATP]A:408 |
4 |
1 |
605 |
f |
[MG]B:402 |
x,y,z |
1_555 |
1 |
1 |
98 |
40.7 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.060 |
32 |
|
[ATP]B:409 |
6 |
1 |
615 |
f |
[MG]B:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
40.4 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.060 |
Average: |
40.6 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.060 |
32 |
33 |
|
[UMQ]B:406 |
5 |
1 |
755 |
◊ |
[UMQ]B:408 |
x,y,z |
1_555 |
3 |
1 |
238 |
35.7 |
-3.3 |
0.466 |
0 |
0 |
0 |
0.015 |
33 |
34 |
|
[UMQ]B:408 |
2 |
1 |
238 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
17538 |
30.1 |
-3.5 |
0.376 |
0 |
0 |
0 |
0.016 |
34 |
35 |
|
[MG]B:402 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
4 |
3 |
18067 |
27.2 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.010 |
35 |
36 |
|
[ATP]B:409 |
4 |
1 |
615 |
◊ |
[ATP]A:408 |
x,y,z |
1_555 |
3 |
1 |
605 |
26.8 |
0.7 |
0.573 |
0 |
0 |
0 |
0.000 |
36 |
37 |
|
[MG]B:401 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
17538 |
21.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.009 |
37 |
38 |
|
[MG]B:401 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
1 |
18067 |
18.5 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.010 |
38 |
39 |
|
[UMQ]A:405 |
1 |
1 |
805 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
18067 |
15.7 |
-0.5 |
0.292 |
0 |
0 |
0 |
0.002 |
39 |
40 |
|
[MG]B:402 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
17538 |
12.7 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.007 |
|