## |
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 |
53 |
18 |
14458 |
◊ |
A |
x,y,z |
1_555 |
47 |
12 |
14619 |
446.1 |
-4.4 |
0.225 |
9 |
0 |
0 |
0.000 |
2 |
2 |
|
B |
45 |
15 |
14458 |
x |
B |
-x+1,y-1/2,-z+2 |
2_647 |
35 |
11 |
14458 |
346.2 |
-1.7 |
0.443 |
5 |
2 |
0 |
0.000 |
3 |
|
A |
34 |
11 |
14619 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
44 |
15 |
14619 |
329.5 |
-1.4 |
0.477 |
5 |
2 |
0 |
0.000 |
Average: |
337.8 |
-1.6 |
0.460 |
5 |
2 |
0 |
0.000 |
3 |
4 |
|
[KDM]A:500 |
17 |
1 |
397 |
f |
A |
x,y,z |
1_555 |
35 |
15 |
14619 |
267.0 |
6.3 |
0.411 |
12 |
0 |
0 |
0.000 |
5 |
|
[KDM]B:500 |
17 |
1 |
399 |
f |
B |
x,y,z |
1_555 |
34 |
15 |
14458 |
265.8 |
6.1 |
0.422 |
11 |
0 |
0 |
0.000 |
Average: |
266.4 |
6.2 |
0.417 |
12 |
0 |
0 |
0.000 |
4 |
6 |
|
[KDM]A:501 |
18 |
1 |
389 |
f |
A |
x,y,z |
1_555 |
32 |
12 |
14619 |
239.8 |
3.3 |
0.265 |
6 |
0 |
0 |
0.000 |
7 |
|
[KDM]B:501 |
18 |
1 |
393 |
f |
B |
x,y,z |
1_555 |
31 |
11 |
14458 |
236.5 |
3.3 |
0.297 |
5 |
0 |
0 |
0.000 |
Average: |
238.2 |
3.3 |
0.281 |
6 |
0 |
0 |
0.000 |
5 |
8 |
|
B |
24 |
8 |
14458 |
◊ |
A |
-x+2,y-1/2,-z+2 |
2_747 |
23 |
8 |
14619 |
196.7 |
-0.4 |
0.486 |
2 |
0 |
0 |
0.000 |
6 |
9 |
|
A |
14 |
6 |
14619 |
◊ |
B |
x,y,z-1 |
1_554 |
18 |
7 |
14458 |
152.5 |
-0.3 |
0.518 |
2 |
0 |
0 |
0.000 |
7 |
10 |
|
[GOL]B:503 |
6 |
1 |
218 |
f |
B |
x,y,z |
1_555 |
18 |
10 |
14458 |
128.0 |
-0.4 |
0.504 |
5 |
0 |
0 |
0.023 |
8 |
11 |
|
[GOL]A:503 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
14619 |
127.1 |
-0.3 |
0.538 |
5 |
0 |
0 |
0.020 |
9 |
12 |
|
[GOL]B:505 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
14458 |
107.7 |
0.7 |
0.607 |
2 |
0 |
0 |
0.002 |
10 |
13 |
|
[GOL]A:504 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
17 |
4 |
14619 |
96.3 |
-0.1 |
0.596 |
1 |
0 |
0 |
0.005 |
11 |
14 |
|
[GOL]B:504 |
6 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
17 |
4 |
14458 |
94.2 |
-0.3 |
0.586 |
1 |
0 |
0 |
0.006 |
12 |
15 |
|
[NO2]A:505 |
3 |
1 |
153 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
14619 |
85.1 |
1.7 |
0.836 |
3 |
0 |
0 |
0.000 |
13 |
16 |
|
[NA]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
14619 |
64.5 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.099 |
17 |
|
[NA]B:502 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
14458 |
64.1 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.099 |
Average: |
64.3 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.099 |
14 |
18 |
|
B |
7 |
2 |
14458 |
◊ |
A |
-x+1,y-1/2,-z+2 |
2_647 |
5 |
2 |
14619 |
62.5 |
1.0 |
0.832 |
2 |
3 |
0 |
0.000 |
15 |
19 |
|
B |
9 |
4 |
14458 |
◊ |
[GOL]B:504 |
-x+1,y-1/2,-z+2 |
2_647 |
4 |
1 |
216 |
61.5 |
0.4 |
0.622 |
2 |
0 |
0 |
0.000 |
16 |
20 |
|
[GOL]A:504 |
3 |
1 |
217 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
8 |
4 |
14619 |
60.0 |
0.4 |
0.696 |
2 |
0 |
0 |
0.000 |
17 |
21 |
|
B |
5 |
3 |
14458 |
x |
B |
-x+2,y-1/2,-z+2 |
2_747 |
3 |
2 |
14458 |
50.5 |
-0.2 |
0.473 |
0 |
0 |
0 |
0.000 |
18 |
22 |
|
A |
5 |
3 |
14619 |
x |
A |
-x+2,y-1/2,-z+1 |
2_746 |
7 |
3 |
14619 |
42.7 |
-0.2 |
0.490 |
1 |
0 |
0 |
0.000 |
19 |
23 |
|
[GOL]B:505 |
2 |
1 |
219 |
f |
[KDM]B:500 |
x,y,z |
1_555 |
4 |
1 |
399 |
37.8 |
0.9 |
0.373 |
2 |
0 |
0 |
0.000 |
20 |
24 |
|
[GOL]B:505 |
4 |
1 |
219 |
f |
[KDM]B:501 |
x,y,z |
1_555 |
4 |
1 |
393 |
29.4 |
0.7 |
0.413 |
0 |
0 |
0 |
0.000 |
21 |
25 |
|
[KDM]B:501 |
1 |
1 |
393 |
f |
[KDM]B:500 |
x,y,z |
1_555 |
3 |
1 |
399 |
9.4 |
0.5 |
0.254 |
0 |
0 |
0 |
0.000 |
26 |
|
[KDM]A:501 |
1 |
1 |
389 |
f |
[KDM]A:500 |
x,y,z |
1_555 |
2 |
1 |
397 |
1.8 |
0.0 |
0.140 |
0 |
0 |
0 |
0.000 |
Average: |
5.6 |
0.3 |
0.197 |
0 |
0 |
0 |
0.000 |
22 |
27 |
|
B |
2 |
1 |
14458 |
◊ |
A |
x,y-1,z+1 |
1_546 |
2 |
1 |
14619 |
7.9 |
-0.1 |
0.473 |
0 |
0 |
0 |
0.000 |
|