## |
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 |
178 |
44 |
8573 |
◊ |
A |
x,y,z |
1_555 |
175 |
45 |
8642 |
1547.5 |
-16.4 |
0.389 |
21 |
2 |
0 |
0.222 |
2 |
2 |
|
A |
49 |
16 |
8642 |
x |
A |
-y,x-y-1,z+1/3 |
2_545 |
44 |
10 |
8642 |
386.8 |
-5.5 |
0.370 |
2 |
1 |
0 |
0.000 |
3 |
|
B |
44 |
10 |
8573 |
x |
B |
-y-1,x-y-1,z+1/3 |
2_445 |
55 |
17 |
8573 |
371.6 |
-5.0 |
0.417 |
2 |
0 |
0 |
0.000 |
Average: |
379.2 |
-5.3 |
0.393 |
2 |
1 |
0 |
0.000 |
3 |
4 |
|
A |
25 |
7 |
8642 |
◊ |
B |
-y-1,x-y-1,z+1/3 |
2_445 |
22 |
10 |
8573 |
235.8 |
-3.2 |
0.280 |
1 |
0 |
0 |
0.000 |
5 |
|
A |
23 |
10 |
8642 |
◊ |
B |
-y,x-y-1,z+1/3 |
2_545 |
25 |
8 |
8573 |
232.5 |
-2.1 |
0.372 |
1 |
0 |
0 |
0.000 |
Average: |
234.2 |
-2.7 |
0.326 |
1 |
0 |
0 |
0.000 |
4 |
6 |
|
[1TD]B:308 |
18 |
1 |
437 |
◊ |
A |
x,y,z |
1_555 |
34 |
9 |
8642 |
201.6 |
4.2 |
0.518 |
0 |
0 |
0 |
0.000 |
7 |
|
[1TD]A:308 |
18 |
1 |
437 |
◊ |
B |
x,y,z |
1_555 |
33 |
9 |
8573 |
199.7 |
4.2 |
0.485 |
0 |
0 |
0 |
0.000 |
Average: |
200.7 |
4.2 |
0.502 |
0 |
0 |
0 |
0.000 |
5 |
8 |
|
[1TD]A:308 |
15 |
1 |
437 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
8642 |
130.9 |
-0.5 |
0.216 |
4 |
0 |
0 |
0.034 |
9 |
|
[1TD]B:308 |
15 |
1 |
437 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
8573 |
129.8 |
0.1 |
0.242 |
4 |
0 |
0 |
0.034 |
Average: |
130.3 |
-0.2 |
0.229 |
4 |
0 |
0 |
0.034 |
6 |
10 |
|
B |
13 |
4 |
8573 |
◊ |
A |
-y,x-y-1,z-2/3 |
2_544 |
11 |
4 |
8642 |
102.9 |
-1.2 |
0.457 |
0 |
0 |
0 |
0.000 |
11 |
|
B |
11 |
4 |
8573 |
◊ |
A |
-y-1,x-y-1,z-2/3 |
2_444 |
14 |
4 |
8642 |
101.7 |
-1.2 |
0.426 |
0 |
0 |
0 |
0.000 |
Average: |
102.3 |
-1.2 |
0.441 |
0 |
0 |
0 |
0.000 |
7 |
12 |
|
[SO4]B:302 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
8573 |
102.6 |
-14.0 |
0.842 |
3 |
0 |
0 |
0.131 |
8 |
13 |
|
[SO4]A:302 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
8642 |
100.4 |
-13.8 |
0.849 |
3 |
0 |
0 |
0.129 |
9 |
14 |
|
[SO4]B:303 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
8573 |
100.3 |
-15.9 |
0.751 |
0 |
0 |
0 |
0.136 |
10 |
15 |
|
[GOL]A:309 |
6 |
1 |
223 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
8642 |
97.3 |
0.7 |
0.715 |
4 |
0 |
0 |
0.009 |
11 |
16 |
|
[EDO]B:305 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
8573 |
82.5 |
1.5 |
0.261 |
2 |
0 |
0 |
0.000 |
12 |
17 |
|
[SO4]B:304 |
4 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
8573 |
79.9 |
-12.9 |
0.753 |
4 |
0 |
0 |
0.125 |
13 |
18 |
|
[SO4]A:301 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
8642 |
78.9 |
-11.2 |
0.890 |
4 |
0 |
0 |
0.111 |
14 |
19 |
|
[SO4]B:301 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
8573 |
78.6 |
-11.2 |
0.885 |
4 |
0 |
0 |
0.111 |
15 |
20 |
|
B |
4 |
2 |
8573 |
◊ |
[SO4]B:301 |
-y-1,x-y-1,z+1/3 |
2_445 |
4 |
1 |
185 |
52.8 |
-5.9 |
0.871 |
0 |
0 |
0 |
0.000 |
16 |
21 |
|
[SO4]B:303 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
6 |
4 |
8642 |
40.8 |
-4.8 |
0.924 |
1 |
0 |
0 |
0.045 |
17 |
22 |
|
A |
4 |
2 |
8642 |
◊ |
[EDO]B:305 |
-y-1,x-y-1,z+1/3 |
2_445 |
2 |
1 |
186 |
38.5 |
0.7 |
0.385 |
0 |
0 |
0 |
0.000 |
18 |
23 |
|
[EDO]B:305 |
2 |
1 |
186 |
f |
[SO4]B:304 |
x,y,z |
1_555 |
3 |
1 |
187 |
35.1 |
-2.9 |
0.704 |
0 |
0 |
0 |
0.025 |
19 |
24 |
|
[SO4]A:301 |
3 |
1 |
185 |
◊ |
A |
-y,x-y-1,z+1/3 |
2_545 |
3 |
1 |
8642 |
29.8 |
-3.8 |
0.586 |
0 |
0 |
0 |
0.000 |
20 |
25 |
|
[GOL]A:309 |
3 |
1 |
223 |
◊ |
B |
-y,x-y-1,z+1/3 |
2_545 |
4 |
2 |
8573 |
29.5 |
-0.0 |
0.570 |
0 |
0 |
0 |
0.000 |
21 |
26 |
|
A |
1 |
1 |
8642 |
◊ |
[1TD]B:308 |
-y,x-y-1,z+1/3 |
2_545 |
3 |
1 |
437 |
13.8 |
-0.1 |
0.225 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
A |
2 |
1 |
8642 |
◊ |
[SO4]B:304 |
-y-1,x-y-1,z+1/3 |
2_445 |
1 |
1 |
187 |
8.5 |
-1.2 |
0.594 |
0 |
0 |
0 |
0.000 |
|