## |
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 |
|
[MH0]A:201 |
43 |
1 |
803 |
f |
A |
x,y,z |
1_555 |
71 |
23 |
7583 |
578.7 |
-18.7 |
0.341 |
2 |
0 |
0 |
0.070 |
2 |
|
[MH0]B:201 |
42 |
1 |
805 |
f |
B |
x,y,z |
1_555 |
68 |
23 |
7480 |
544.9 |
-15.7 |
0.384 |
2 |
0 |
0 |
0.070 |
Average: |
561.8 |
-17.2 |
0.362 |
2 |
0 |
0 |
0.070 |
2 |
3 |
|
B |
49 |
14 |
7480 |
◊ |
A |
x,y,z |
1_555 |
57 |
14 |
7583 |
440.8 |
0.2 |
0.699 |
2 |
2 |
0 |
0.000 |
3 |
4 |
|
B |
43 |
15 |
7480 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
33 |
10 |
7583 |
308.5 |
-2.7 |
0.388 |
2 |
0 |
0 |
0.000 |
5 |
|
B |
30 |
9 |
7480 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
39 |
14 |
7583 |
301.4 |
-2.7 |
0.366 |
2 |
0 |
0 |
0.000 |
Average: |
305.0 |
-2.7 |
0.377 |
2 |
0 |
0 |
0.000 |
4 |
6 |
|
A |
25 |
7 |
7583 |
◊ |
B |
x-1/2,-y+1/2,-z-1 |
4_454 |
24 |
7 |
7480 |
232.0 |
-2.3 |
0.344 |
4 |
4 |
0 |
0.000 |
5 |
7 |
|
A |
22 |
8 |
7583 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
22 |
8 |
7480 |
222.9 |
-1.8 |
0.374 |
2 |
0 |
0 |
0.000 |
8 |
|
A |
21 |
9 |
7583 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
18 |
7 |
7480 |
189.6 |
-0.9 |
0.481 |
2 |
0 |
0 |
0.000 |
Average: |
206.3 |
-1.4 |
0.428 |
2 |
0 |
0 |
0.000 |
6 |
9 |
|
A |
23 |
6 |
7583 |
x |
A |
-x-1/2,-y,z-1/2 |
2_454 |
22 |
5 |
7583 |
204.2 |
-1.4 |
0.454 |
2 |
0 |
0 |
0.000 |
7 |
10 |
|
[MWJ]B:202 |
9 |
1 |
298 |
f |
B |
x,y,z |
1_555 |
27 |
11 |
7480 |
159.9 |
3.5 |
0.309 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
[MWJ]A:203 |
9 |
1 |
294 |
f |
A |
x,y,z |
1_555 |
26 |
9 |
7583 |
155.6 |
2.5 |
0.234 |
0 |
0 |
0 |
0.000 |
9 |
12 |
|
B |
21 |
5 |
7480 |
x |
B |
-x,y-1/2,-z-1/2 |
3_544 |
15 |
5 |
7480 |
151.5 |
-1.3 |
0.417 |
0 |
0 |
0 |
0.000 |
10 |
13 |
|
B |
17 |
5 |
7480 |
x |
B |
-x+1/2,-y,z-1/2 |
2_554 |
19 |
4 |
7480 |
150.4 |
0.9 |
0.637 |
1 |
0 |
0 |
0.000 |
14 |
|
A |
13 |
4 |
7583 |
x |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
11 |
5 |
7583 |
108.7 |
-0.0 |
0.534 |
0 |
0 |
0 |
0.000 |
Average: |
129.6 |
0.4 |
0.585 |
1 |
0 |
0 |
0.000 |
11 |
15 |
|
A |
20 |
9 |
7583 |
◊ |
B |
x-1,y,z |
1_455 |
19 |
6 |
7480 |
134.6 |
1.8 |
0.820 |
0 |
2 |
0 |
0.000 |
12 |
16 |
|
[EDO]A:202 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
18 |
7 |
7583 |
109.7 |
3.8 |
0.509 |
4 |
0 |
0 |
0.000 |
13 |
17 |
|
[MWJ]A:203 |
6 |
1 |
294 |
f |
[MH0]A:201 |
x,y,z |
1_555 |
24 |
1 |
803 |
89.9 |
0.4 |
0.402 |
0 |
0 |
0 |
0.000 |
14 |
18 |
|
B |
11 |
6 |
7480 |
f |
[SO4]A:206 |
-x-1/2,-y,z-1/2 |
2_454 |
4 |
1 |
182 |
71.4 |
-11.0 |
0.650 |
2 |
0 |
0 |
0.050 |
15 |
19 |
|
B |
12 |
5 |
7480 |
◊ |
[SO4]A:205 |
-x,y-1/2,-z-1/2 |
3_544 |
5 |
1 |
182 |
71.0 |
-10.3 |
0.721 |
2 |
0 |
0 |
0.000 |
16 |
20 |
|
[SO4]A:205 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
7583 |
70.9 |
-10.7 |
0.682 |
2 |
0 |
0 |
0.041 |
17 |
21 |
|
[EDO]A:204 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
7583 |
70.9 |
2.9 |
0.539 |
2 |
0 |
0 |
0.000 |
18 |
22 |
|
[SO4]A:206 |
5 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
7583 |
68.7 |
-10.0 |
0.727 |
2 |
0 |
0 |
0.000 |
19 |
23 |
|
[EDO]A:204 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
13 |
5 |
7480 |
64.4 |
1.8 |
0.285 |
2 |
0 |
0 |
0.000 |
20 |
24 |
|
[MWJ]B:202 |
5 |
1 |
298 |
f |
[MH0]B:201 |
x,y,z |
1_555 |
21 |
1 |
805 |
59.9 |
0.9 |
0.451 |
0 |
0 |
0 |
0.000 |
21 |
25 |
|
B |
4 |
2 |
7480 |
f |
[EDO]A:202 |
-x,y-1/2,-z-1/2 |
3_544 |
2 |
1 |
184 |
30.3 |
0.9 |
0.753 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[EDO]A:204 |
2 |
1 |
183 |
f |
A |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
7583 |
6.2 |
0.1 |
0.529 |
0 |
0 |
0 |
0.000 |
|