## |
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 |
288 |
67 |
14883 |
◊ |
A |
x,y,z |
1_555 |
300 |
77 |
14335 |
2892.6 |
-47.8 |
0.004 |
19 |
12 |
0 |
0.378 |
2 |
2 |
|
B |
104 |
29 |
14883 |
◊ |
B |
x,x-y,-z+13/6 |
12_557 |
101 |
29 |
14883 |
1096.1 |
-12.1 |
0.233 |
8 |
8 |
0 |
0.142 |
3 |
3 |
|
B |
53 |
13 |
14883 |
◊ |
A |
x,x-y,-z+13/6 |
12_557 |
48 |
13 |
14335 |
471.8 |
-2.2 |
0.535 |
3 |
0 |
0 |
0.020 |
4 |
4 |
|
[ATP]A:503 |
31 |
1 |
584 |
f |
A |
x,y,z |
1_555 |
58 |
23 |
14335 |
422.3 |
-3.1 |
0.456 |
13 |
0 |
0 |
0.086 |
5 |
5 |
|
B |
42 |
15 |
14883 |
◊ |
A |
x-y,-y+1,-z+2 |
8_567 |
42 |
15 |
14335 |
421.0 |
-6.2 |
0.195 |
2 |
0 |
0 |
0.068 |
6 |
6 |
|
[ATP]B:501 |
31 |
1 |
594 |
f |
B |
x,y,z |
1_555 |
57 |
23 |
14883 |
390.1 |
-2.7 |
0.546 |
17 |
0 |
0 |
0.172 |
7 |
7 |
|
A |
21 |
5 |
14335 |
◊ |
A |
x,x-y,-z+13/6 |
12_557 |
21 |
5 |
14335 |
195.2 |
-0.3 |
0.628 |
4 |
2 |
0 |
0.007 |
8 |
8 |
|
A |
20 |
4 |
14335 |
◊ |
A |
-y+2,-x+2,-z+11/6 |
10_776 |
22 |
5 |
14335 |
169.8 |
-2.6 |
0.307 |
0 |
0 |
0 |
0.011 |
9 |
9 |
|
[SO4]A:506 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
14335 |
72.9 |
-8.0 |
0.956 |
2 |
0 |
0 |
0.086 |
10 |
10 |
|
[SO4]B:504 |
4 |
1 |
186 |
f |
A |
x,x-y,-z+13/6 |
12_557 |
14 |
4 |
14335 |
62.5 |
-8.4 |
0.732 |
2 |
0 |
0 |
0.090 |
11 |
11 |
|
[SO4]A:505 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
15 |
4 |
14883 |
59.4 |
-8.1 |
0.787 |
2 |
0 |
0 |
0.151 |
12 |
12 |
|
[SO4]B:503 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
14883 |
51.5 |
-7.0 |
0.727 |
3 |
0 |
0 |
0.141 |
13 |
13 |
|
[SO4]B:503 |
4 |
1 |
185 |
◊ |
B |
x,x-y,-z+13/6 |
12_557 |
8 |
2 |
14883 |
51.5 |
-7.0 |
0.719 |
3 |
0 |
0 |
0.140 |
14 |
14 |
|
B |
8 |
3 |
14883 |
f |
[SO4]A:501 |
x-y,-y+1,-z+2 |
8_567 |
4 |
1 |
185 |
50.1 |
-5.5 |
0.899 |
2 |
0 |
0 |
0.107 |
15 |
15 |
|
[MG]A:504 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
14335 |
49.9 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.061 |
16 |
16 |
|
[SO4]A:502 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
14335 |
48.6 |
-5.6 |
0.917 |
2 |
0 |
0 |
0.063 |
17 |
17 |
|
[ATP]B:501 |
4 |
1 |
594 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
14335 |
47.6 |
1.2 |
0.780 |
1 |
0 |
0 |
0.000 |
18 |
18 |
|
[SO4]A:501 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
14335 |
43.9 |
-4.4 |
0.945 |
1 |
0 |
0 |
0.047 |
19 |
19 |
|
B |
3 |
2 |
14883 |
◊ |
[SO4]A:502 |
x-y,-y+1,-z+2 |
8_567 |
3 |
1 |
185 |
42.7 |
-4.6 |
0.944 |
1 |
0 |
0 |
0.049 |
20 |
20 |
|
[SO4]A:505 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
14335 |
39.0 |
-3.7 |
0.963 |
2 |
0 |
0 |
0.030 |
21 |
21 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
14883 |
37.4 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.079 |
22 |
22 |
|
[MG]B:502 |
1 |
1 |
98 |
f |
[ATP]B:501 |
x,y,z |
1_555 |
5 |
1 |
594 |
31.2 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.078 |
23 |
|
[MG]A:504 |
1 |
1 |
98 |
f |
[ATP]A:503 |
x,y,z |
1_555 |
3 |
1 |
584 |
31.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.078 |
Average: |
31.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.078 |
23 |
24 |
|
[SO4]B:504 |
3 |
1 |
186 |
◊ |
B |
x,x-y,-z+13/6 |
12_557 |
4 |
1 |
14883 |
29.5 |
-2.6 |
0.960 |
1 |
0 |
0 |
0.020 |
24 |
25 |
|
[SO4]A:506 |
2 |
1 |
184 |
◊ |
B |
x,x-y,-z+13/6 |
12_557 |
3 |
1 |
14883 |
23.9 |
-2.9 |
0.800 |
0 |
0 |
0 |
0.016 |
25 |
26 |
|
[MG]B:502 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
14335 |
12.0 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.008 |
26 |
27 |
|
[SO4]A:506 |
1 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
14883 |
5.7 |
-0.8 |
0.644 |
0 |
0 |
0 |
0.005 |
|