## |
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 |
56 |
14 |
8684 |
◊ |
A |
x,y,z |
1_555 |
66 |
15 |
8257 |
584.6 |
-10.9 |
0.082 |
3 |
1 |
0 |
1.000 |
2 |
2 |
|
B |
38 |
15 |
8684 |
x |
B |
x,y-1,z |
1_545 |
37 |
15 |
8684 |
356.4 |
-0.4 |
0.675 |
0 |
0 |
0 |
0.000 |
3 |
|
C |
35 |
13 |
8034 |
x |
C |
x,y-1,z |
1_545 |
31 |
13 |
8034 |
294.3 |
0.6 |
0.620 |
4 |
0 |
0 |
0.000 |
4 |
|
A |
36 |
14 |
8257 |
x |
A |
x,y-1,z |
1_545 |
33 |
14 |
8257 |
293.9 |
1.5 |
0.747 |
5 |
0 |
0 |
0.000 |
Average: |
314.8 |
0.6 |
0.681 |
3 |
0 |
0 |
0.000 |
3 |
5 |
|
A |
33 |
13 |
8257 |
◊ |
B |
-x,y-1,-z |
2_545 |
35 |
7 |
8684 |
313.5 |
-2.1 |
0.518 |
4 |
0 |
0 |
0.000 |
4 |
6 |
|
C |
35 |
16 |
8034 |
◊ |
B |
-x,y,-z-1 |
2_554 |
37 |
12 |
8684 |
305.8 |
-0.6 |
0.603 |
1 |
0 |
0 |
0.000 |
5 |
7 |
|
[F86]B:201 |
20 |
1 |
447 |
◊ |
B |
x,y,z |
1_555 |
39 |
17 |
8684 |
302.5 |
1.1 |
0.303 |
2 |
0 |
0 |
0.000 |
8 |
|
[F86]C:201 |
20 |
1 |
447 |
◊ |
C |
x,y,z |
1_555 |
37 |
17 |
8034 |
290.5 |
0.9 |
0.241 |
2 |
0 |
0 |
0.000 |
9 |
|
[F86]A:201 |
20 |
1 |
447 |
◊ |
A |
x,y,z |
1_555 |
41 |
17 |
8257 |
273.6 |
0.8 |
0.302 |
1 |
0 |
0 |
0.000 |
Average: |
288.9 |
0.9 |
0.282 |
2 |
0 |
0 |
0.000 |
6 |
10 |
|
A |
30 |
12 |
8257 |
◊ |
A |
-x,y,-z |
2_555 |
31 |
12 |
8257 |
297.2 |
-0.8 |
0.654 |
2 |
2 |
0 |
0.000 |
7 |
11 |
|
B |
26 |
8 |
8684 |
◊ |
A |
-x,y,-z |
2_555 |
31 |
10 |
8257 |
282.4 |
-4.2 |
0.205 |
2 |
0 |
0 |
0.000 |
8 |
12 |
|
C |
26 |
10 |
8034 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
31 |
7 |
8257 |
254.4 |
-1.5 |
0.453 |
5 |
0 |
0 |
0.000 |
9 |
13 |
|
C |
28 |
9 |
8034 |
◊ |
B |
-x,y-1,-z-1 |
2_544 |
27 |
8 |
8684 |
239.7 |
-2.3 |
0.426 |
1 |
1 |
0 |
0.000 |
10 |
14 |
|
A |
28 |
7 |
8257 |
x |
A |
-x+1/2,y-1/2,-z |
4_545 |
23 |
6 |
8257 |
238.8 |
-2.7 |
0.381 |
0 |
0 |
0 |
0.000 |
11 |
15 |
|
[EDO]A:203 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
18 |
10 |
8257 |
117.7 |
3.2 |
0.480 |
1 |
0 |
0 |
0.000 |
12 |
16 |
|
B |
13 |
4 |
8684 |
◊ |
C |
x-1/2,y+1/2,z |
3_455 |
10 |
5 |
8034 |
83.1 |
0.4 |
0.714 |
0 |
0 |
0 |
0.000 |
13 |
17 |
|
[EDO]C:202 |
4 |
1 |
183 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
13 |
4 |
8257 |
81.1 |
2.3 |
0.447 |
1 |
0 |
0 |
0.000 |
14 |
18 |
|
[EDO]A:202 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
15 |
7 |
8257 |
75.5 |
1.8 |
0.256 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[EDO]A:202 |
4 |
1 |
184 |
◊ |
A |
-x,y,-z |
2_555 |
10 |
3 |
8257 |
71.2 |
1.1 |
0.204 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
[EDO]C:203 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
8034 |
70.5 |
1.1 |
0.195 |
1 |
0 |
0 |
0.000 |
17 |
21 |
|
[EDO]C:202 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
12 |
4 |
8034 |
65.2 |
1.1 |
0.778 |
3 |
0 |
0 |
0.000 |
18 |
22 |
|
C |
11 |
4 |
8034 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
8257 |
63.2 |
-1.1 |
0.383 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[EDO]A:204 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
8257 |
62.9 |
0.4 |
0.506 |
0 |
0 |
0 |
0.000 |
20 |
24 |
|
C |
13 |
4 |
8034 |
◊ |
[EDO]C:203 |
x,y-1,z |
1_545 |
4 |
1 |
184 |
58.7 |
1.4 |
0.802 |
1 |
0 |
0 |
0.000 |
21 |
25 |
|
A |
11 |
4 |
8257 |
◊ |
[EDO]A:204 |
x,y-1,z |
1_545 |
3 |
1 |
184 |
55.4 |
1.7 |
0.581 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
[F86]A:201 |
8 |
1 |
447 |
f |
B |
-x,y,-z |
2_555 |
2 |
1 |
8684 |
46.4 |
-0.2 |
0.044 |
0 |
0 |
0 |
0.018 |
23 |
27 |
|
A |
7 |
3 |
8257 |
◊ |
C |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
8034 |
46.2 |
1.6 |
0.834 |
1 |
0 |
0 |
0.000 |
24 |
28 |
|
C |
3 |
1 |
8034 |
f |
[F86]C:201 |
x,y-1,z |
1_545 |
5 |
1 |
447 |
44.2 |
1.4 |
0.626 |
0 |
0 |
0 |
0.000 |
29 |
|
B |
3 |
1 |
8684 |
f |
[F86]B:201 |
x,y-1,z |
1_545 |
5 |
1 |
447 |
43.0 |
1.5 |
0.632 |
0 |
0 |
0 |
0.000 |
Average: |
43.6 |
1.5 |
0.629 |
0 |
0 |
0 |
0.000 |
25 |
30 |
|
[EDO]C:203 |
3 |
1 |
184 |
◊ |
[F86]C:201 |
x,y,z |
1_555 |
4 |
1 |
447 |
42.8 |
1.7 |
0.616 |
1 |
0 |
0 |
0.000 |
26 |
31 |
|
A |
3 |
1 |
8257 |
◊ |
[F86]A:201 |
x,y-1,z |
1_545 |
5 |
1 |
447 |
37.3 |
1.2 |
0.607 |
0 |
0 |
0 |
0.000 |
27 |
32 |
|
[EDO]A:204 |
3 |
1 |
184 |
◊ |
[F86]A:201 |
x,y,z |
1_555 |
5 |
1 |
447 |
37.0 |
1.3 |
0.549 |
2 |
0 |
0 |
0.000 |
28 |
33 |
|
[EDO]A:204 |
3 |
1 |
184 |
◊ |
B |
-x,y,-z |
2_555 |
3 |
1 |
8684 |
26.1 |
0.0 |
0.467 |
0 |
0 |
0 |
0.000 |
29 |
34 |
|
C |
4 |
1 |
8034 |
◊ |
B |
x,y-1,z |
1_545 |
2 |
1 |
8684 |
24.6 |
0.3 |
0.747 |
0 |
0 |
0 |
0.000 |
30 |
35 |
|
A |
3 |
2 |
8257 |
◊ |
B |
x,y-1,z |
1_545 |
2 |
1 |
8684 |
23.7 |
0.5 |
0.837 |
1 |
0 |
0 |
0.000 |
31 |
36 |
|
A |
3 |
1 |
8257 |
f |
[EDO]A:203 |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
182 |
15.8 |
-0.0 |
0.632 |
0 |
0 |
0 |
0.003 |
32 |
37 |
|
[EDO]A:202 |
1 |
1 |
184 |
f |
[EDO]A:202 |
-x,y,-z |
2_555 |
1 |
1 |
184 |
10.5 |
0.2 |
1.000 |
0 |
0 |
0 |
0.000 |
|