| ## |
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 |
|
A |
54 |
16 |
19241 |
x |
A |
-y-1,x-y,z-1/3 |
2_454 |
73 |
21 |
19241 |
589.2 |
-2.8 |
0.569 |
1 |
0 |
0 |
0.000 |
2 |
|
B |
55 |
17 |
19430 |
x |
B |
-y,x-y+1,z-1/3 |
2_564 |
69 |
22 |
19430 |
563.2 |
-4.4 |
0.392 |
1 |
0 |
0 |
0.000 |
| Average: |
576.2 |
-3.6 |
0.481 |
1 |
0 |
0 |
0.000 |
| 2 |
3 |
|
C |
53 |
15 |
19274 |
x |
C |
-y,x-y,z-1/3 |
2_554 |
72 |
21 |
19274 |
568.8 |
-3.1 |
0.532 |
0 |
0 |
0 |
0.000 |
| 3 |
4 |
|
C |
53 |
15 |
19274 |
◊ |
A |
x,y,z |
1_555 |
54 |
17 |
19241 |
488.0 |
0.2 |
0.682 |
5 |
4 |
0 |
0.000 |
| 4 |
5 |
|
A |
52 |
20 |
19241 |
◊ |
B |
x-1,y-1,z |
1_445 |
51 |
15 |
19430 |
475.5 |
-6.8 |
0.146 |
0 |
0 |
0 |
0.000 |
| 5 |
6 |
|
C |
41 |
11 |
19274 |
◊ |
B |
x,y,z |
1_555 |
38 |
11 |
19430 |
346.7 |
0.6 |
0.768 |
2 |
3 |
0 |
0.000 |
| 6 |
7 |
|
B |
42 |
11 |
19430 |
◊ |
A |
x,y,z |
1_555 |
32 |
13 |
19241 |
311.6 |
-0.3 |
0.711 |
2 |
2 |
0 |
0.000 |
| 7 |
8 |
|
A |
30 |
10 |
19241 |
◊ |
C |
x-1,y,z |
1_455 |
34 |
13 |
19274 |
296.0 |
-4.7 |
0.155 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[XUL]B:1531 |
10 |
1 |
290 |
f |
B |
x,y,z |
1_555 |
31 |
13 |
19430 |
181.0 |
0.0 |
0.451 |
4 |
0 |
0 |
0.000 |
10 |
|
[XUL]A:1532 |
10 |
1 |
288 |
f |
A |
x,y,z |
1_555 |
31 |
14 |
19241 |
179.5 |
0.3 |
0.469 |
4 |
0 |
0 |
0.000 |
11 |
|
[XUL]C:1531 |
10 |
1 |
290 |
f |
C |
x,y,z |
1_555 |
33 |
13 |
19274 |
177.4 |
0.4 |
0.470 |
4 |
0 |
0 |
0.000 |
| Average: |
179.3 |
0.3 |
0.463 |
4 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[EDO]B:1532 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
10 |
19430 |
115.0 |
2.6 |
0.345 |
1 |
0 |
0 |
0.000 |
| 10 |
13 |
|
[EDO]C:1532 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
16 |
9 |
19274 |
111.9 |
3.5 |
0.440 |
1 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[EDO]A:1533 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
19241 |
111.8 |
3.5 |
0.434 |
2 |
0 |
0 |
0.000 |
| 12 |
15 |
|
C |
14 |
6 |
19274 |
◊ |
B |
x,y-1,z |
1_545 |
12 |
8 |
19430 |
73.3 |
-1.1 |
0.386 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
C |
4 |
3 |
19274 |
◊ |
A |
-y-1,x-y,z-1/3 |
2_454 |
6 |
3 |
19241 |
18.8 |
-0.5 |
0.410 |
0 |
0 |
0 |
0.000 |
|