| ## |
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 |
69 |
23 |
12119 |
◊ |
A |
x,y,z |
1_555 |
66 |
17 |
12070 |
758.1 |
-9.7 |
0.112 |
5 |
0 |
0 |
0.068 |
| 2 |
2 |
|
A |
73 |
18 |
12070 |
x |
A |
x-y,x,z+1/6 |
6_555 |
84 |
25 |
12070 |
722.2 |
-4.5 |
0.601 |
7 |
3 |
0 |
0.000 |
3 |
|
B |
82 |
23 |
12119 |
x |
B |
x-y,x,z+1/6 |
6_555 |
67 |
17 |
12119 |
721.3 |
-4.6 |
0.512 |
7 |
3 |
0 |
0.000 |
| Average: |
721.7 |
-4.5 |
0.557 |
7 |
3 |
0 |
0.000 |
| 3 |
4 |
|
A |
79 |
21 |
12070 |
◊ |
B |
-x,-y+1,z-1/2 |
4_564 |
74 |
17 |
12119 |
685.7 |
-11.2 |
0.136 |
4 |
0 |
0 |
0.000 |
| 4 |
5 |
|
[9A0]A:501 |
32 |
1 |
734 |
f |
A |
x,y,z |
1_555 |
73 |
27 |
12070 |
531.7 |
-7.4 |
0.220 |
6 |
0 |
0 |
0.164 |
6 |
|
[9A0]B:501 |
32 |
1 |
727 |
f |
B |
x,y,z |
1_555 |
81 |
27 |
12119 |
512.6 |
-6.5 |
0.300 |
6 |
0 |
0 |
0.164 |
| Average: |
522.2 |
-6.9 |
0.260 |
6 |
0 |
0 |
0.164 |
| 5 |
7 |
|
[DMF]B:506 |
5 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
18 |
7 |
12119 |
120.5 |
3.5 |
0.477 |
0 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[EDO]B:504 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
23 |
8 |
12119 |
108.0 |
3.3 |
0.643 |
3 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[EDO]B:505 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
12119 |
107.0 |
2.6 |
0.474 |
2 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[EDO]A:502 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
23 |
9 |
12070 |
101.6 |
2.0 |
0.364 |
1 |
0 |
0 |
0.000 |
| 9 |
11 |
|
[DMF]A:507 |
5 |
1 |
215 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
12070 |
99.4 |
1.9 |
0.376 |
1 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[EDO]B:503 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
22 |
9 |
12119 |
99.2 |
1.9 |
0.347 |
2 |
0 |
0 |
0.000 |
| 11 |
13 |
|
[EDO]A:503 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
12070 |
93.1 |
2.5 |
0.450 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
[EDO]A:505 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
12070 |
89.4 |
2.5 |
0.467 |
4 |
0 |
0 |
0.000 |
| 13 |
15 |
|
B |
13 |
6 |
12119 |
◊ |
[EDO]B:502 |
x-y,x,z+1/6 |
6_555 |
4 |
1 |
188 |
88.6 |
2.5 |
0.485 |
3 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[EDO]A:506 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
13 |
8 |
12070 |
81.8 |
2.5 |
0.499 |
3 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[EDO]A:504 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
8 |
5 |
12070 |
70.3 |
2.6 |
0.323 |
1 |
0 |
0 |
0.000 |
| 16 |
18 |
|
B |
8 |
3 |
12119 |
◊ |
A |
x-y,x,z+1/6 |
6_555 |
9 |
3 |
12070 |
69.0 |
1.6 |
0.879 |
2 |
2 |
0 |
0.000 |
| 17 |
19 |
|
B |
5 |
3 |
12119 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
5 |
2 |
12070 |
55.6 |
-1.0 |
0.280 |
0 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[EDO]B:502 |
4 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
12119 |
51.3 |
1.3 |
0.767 |
1 |
0 |
0 |
0.000 |
| 19 |
21 |
|
[EDO]A:502 |
2 |
1 |
185 |
f |
[9A0]A:501 |
x,y,z |
1_555 |
6 |
1 |
734 |
46.7 |
0.9 |
0.534 |
1 |
0 |
0 |
0.000 |
| 20 |
22 |
|
[EDO]B:503 |
3 |
1 |
184 |
f |
[9A0]B:501 |
x,y,z |
1_555 |
7 |
1 |
727 |
46.1 |
1.0 |
0.778 |
1 |
0 |
0 |
0.000 |
| 21 |
23 |
|
[DMF]A:507 |
2 |
1 |
215 |
◊ |
A |
x-y,x,z+1/6 |
6_555 |
7 |
3 |
12070 |
44.9 |
2.5 |
0.687 |
0 |
0 |
0 |
0.000 |
| 22 |
24 |
|
[EDO]B:505 |
4 |
1 |
186 |
f |
[9A0]B:501 |
x,y,z |
1_555 |
7 |
1 |
727 |
42.9 |
1.2 |
0.847 |
0 |
0 |
0 |
0.000 |
| 23 |
25 |
|
A |
3 |
1 |
12070 |
f |
[EDO]A:506 |
x-y,x,z+1/6 |
6_555 |
3 |
1 |
184 |
35.3 |
1.6 |
0.982 |
1 |
0 |
0 |
0.000 |
| 24 |
26 |
|
[EDO]A:504 |
2 |
1 |
186 |
f |
B |
-x,-y+1,z-1/2 |
4_564 |
6 |
3 |
12119 |
34.2 |
0.5 |
0.698 |
0 |
0 |
0 |
0.000 |
| 25 |
27 |
|
[EDO]A:506 |
3 |
1 |
184 |
◊ |
[EDO]A:505 |
x,y,z |
1_555 |
3 |
1 |
185 |
29.2 |
1.6 |
1.000 |
0 |
0 |
0 |
0.000 |
| 26 |
28 |
|
[EDO]B:504 |
4 |
1 |
185 |
f |
B |
x-y,x,z+1/6 |
6_555 |
4 |
1 |
12119 |
27.7 |
0.7 |
0.905 |
1 |
0 |
0 |
0.000 |
| 27 |
29 |
|
A |
4 |
1 |
12070 |
◊ |
[EDO]A:505 |
x-y,x,z+1/6 |
6_555 |
3 |
1 |
185 |
25.4 |
1.1 |
0.915 |
0 |
0 |
0 |
0.000 |
| 28 |
30 |
|
A |
3 |
1 |
12070 |
◊ |
[EDO]A:504 |
x-y,x,z+1/6 |
6_555 |
1 |
1 |
186 |
20.2 |
0.8 |
0.952 |
0 |
0 |
0 |
0.000 |
| 29 |
31 |
|
[DMF]A:507 |
2 |
1 |
215 |
f |
[EDO]A:504 |
x-y,x,z+1/6 |
6_555 |
1 |
1 |
186 |
1.7 |
0.1 |
0.490 |
0 |
0 |
0 |
0.000 |
| 30 |
32 |
|
[EDO]A:503 |
1 |
1 |
183 |
f |
A |
x-y,x,z+1/6 |
6_555 |
1 |
1 |
12070 |
1.6 |
0.0 |
0.692 |
0 |
0 |
0 |
0.000 |
|