| ## |
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 |
78 |
21 |
17789 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
70 |
22 |
17785 |
678.2 |
-5.1 |
0.366 |
9 |
1 |
0 |
0.000 |
| 2 |
2 |
|
B |
70 |
15 |
17789 |
x |
B |
-x-1,y-1/2,-z+1 |
2_446 |
63 |
15 |
17789 |
589.7 |
-6.2 |
0.287 |
5 |
4 |
0 |
0.000 |
3 |
|
A |
48 |
12 |
17785 |
x |
A |
-x,y-1/2,-z+2 |
2_547 |
56 |
16 |
17785 |
518.7 |
-6.1 |
0.206 |
6 |
4 |
0 |
0.000 |
| Average: |
554.2 |
-6.2 |
0.246 |
6 |
4 |
0 |
0.000 |
| 3 |
4 |
|
B |
39 |
15 |
17789 |
◊ |
A |
x,y,z |
1_555 |
58 |
18 |
17785 |
455.3 |
-3.7 |
0.360 |
6 |
3 |
0 |
0.000 |
| 4 |
5 |
|
[ATP]A:501 |
29 |
1 |
643 |
f |
A |
x,y,z |
1_555 |
41 |
17 |
17785 |
360.1 |
-0.6 |
0.651 |
10 |
0 |
0 |
0.016 |
| 5 |
6 |
|
[ATP]B:501 |
30 |
1 |
639 |
f |
B |
x,y,z |
1_555 |
38 |
16 |
17789 |
358.2 |
1.1 |
0.745 |
7 |
0 |
0 |
0.007 |
| 6 |
7 |
|
B |
25 |
11 |
17789 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
14 |
7 |
17789 |
141.1 |
-0.4 |
0.609 |
1 |
0 |
0 |
0.000 |
| 7 |
8 |
|
[GOL]B:801 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
17789 |
117.0 |
-0.8 |
0.483 |
1 |
0 |
0 |
0.004 |
| 8 |
9 |
|
[GOL]B:802 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
17789 |
101.5 |
0.6 |
0.695 |
4 |
0 |
0 |
0.004 |
| 9 |
10 |
|
[GOL]A:804 |
6 |
1 |
215 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
17785 |
95.4 |
0.3 |
0.640 |
3 |
0 |
0 |
0.003 |
| 10 |
11 |
|
[GOL]A:803 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
21 |
10 |
17785 |
95.3 |
-0.0 |
0.603 |
2 |
0 |
0 |
0.003 |
| 11 |
12 |
|
[SO4]B:702 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
17789 |
84.8 |
-11.6 |
0.910 |
4 |
0 |
0 |
0.047 |
| 12 |
13 |
|
[SO4]A:701 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
17785 |
83.4 |
-11.2 |
0.910 |
4 |
0 |
0 |
0.042 |
| 13 |
14 |
|
[CL]B:601 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
17789 |
65.9 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.038 |
15 |
|
[CL]A:602 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
17785 |
65.5 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.038 |
| Average: |
65.7 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.038 |
| 14 |
16 |
|
A |
2 |
1 |
17785 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
17789 |
7.5 |
-0.2 |
0.355 |
0 |
0 |
0 |
0.000 |
|