| ## |
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 |
150 |
33 |
10406 |
◊ |
A |
x,y,z |
1_555 |
148 |
33 |
10177 |
1406.8 |
-25.5 |
0.009 |
6 |
2 |
0 |
0.579 |
2 |
|
D |
147 |
33 |
10216 |
◊ |
C |
x,y,z |
1_555 |
149 |
33 |
10392 |
1398.2 |
-25.5 |
0.007 |
6 |
2 |
0 |
0.579 |
| Average: |
1402.5 |
-25.5 |
0.008 |
6 |
2 |
0 |
0.579 |
| 2 |
3 |
|
C |
53 |
14 |
10392 |
◊ |
B |
x,y,z |
1_555 |
45 |
14 |
10406 |
468.4 |
2.6 |
0.799 |
6 |
3 |
0 |
0.000 |
4 |
|
D |
46 |
14 |
10216 |
◊ |
A |
x,y,z |
1_555 |
50 |
14 |
10177 |
457.3 |
2.4 |
0.781 |
7 |
2 |
0 |
0.000 |
5 |
|
C |
51 |
17 |
10392 |
◊ |
B |
x-1,y,z |
1_455 |
46 |
15 |
10406 |
442.6 |
3.0 |
0.793 |
7 |
3 |
0 |
0.000 |
6 |
|
D |
47 |
15 |
10216 |
◊ |
A |
x-1,y,z |
1_455 |
47 |
16 |
10177 |
436.4 |
2.8 |
0.806 |
5 |
2 |
0 |
0.000 |
| Average: |
451.2 |
2.7 |
0.795 |
6 |
3 |
0 |
0.000 |
| 3 |
7 |
|
[TTP]B:301 |
29 |
1 |
574 |
f |
B |
x,y,z |
1_555 |
60 |
27 |
10406 |
404.4 |
-2.0 |
0.648 |
20 |
0 |
0 |
0.421 |
8 |
|
[TTP]A:300 |
29 |
1 |
580 |
f |
A |
x,y,z |
1_555 |
59 |
27 |
10177 |
404.1 |
-1.9 |
0.653 |
18 |
0 |
0 |
0.421 |
9 |
|
[TTP]C:302 |
28 |
1 |
573 |
f |
C |
x,y,z |
1_555 |
60 |
28 |
10392 |
403.3 |
-1.8 |
0.652 |
20 |
0 |
0 |
0.421 |
10 |
|
[TTP]D:303 |
29 |
1 |
575 |
f |
D |
x,y,z |
1_555 |
59 |
27 |
10216 |
392.1 |
-1.8 |
0.632 |
19 |
0 |
0 |
0.421 |
| Average: |
401.0 |
-1.9 |
0.646 |
19 |
0 |
0 |
0.421 |
| 4 |
11 |
|
B |
38 |
9 |
10406 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
37 |
10 |
10177 |
366.5 |
-2.6 |
0.432 |
3 |
0 |
0 |
0.000 |
12 |
|
C |
40 |
10 |
10392 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
40 |
8 |
10216 |
359.2 |
-3.0 |
0.384 |
2 |
4 |
0 |
0.000 |
| Average: |
362.8 |
-2.8 |
0.408 |
3 |
2 |
0 |
0.000 |
| 5 |
13 |
|
B |
16 |
4 |
10406 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
17 |
5 |
10177 |
145.3 |
-0.1 |
0.645 |
3 |
2 |
0 |
0.000 |
14 |
|
C |
18 |
4 |
10392 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
14 |
4 |
10216 |
140.1 |
0.7 |
0.732 |
2 |
2 |
0 |
0.000 |
| Average: |
142.7 |
0.3 |
0.689 |
3 |
2 |
0 |
0.000 |
| 6 |
15 |
|
C |
4 |
1 |
10392 |
◊ |
A |
x-1,y,z |
1_455 |
4 |
1 |
10177 |
45.8 |
-0.3 |
0.479 |
0 |
0 |
0 |
0.000 |
16 |
|
D |
5 |
1 |
10216 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
10406 |
42.9 |
-0.4 |
0.462 |
0 |
0 |
0 |
0.000 |
| Average: |
44.3 |
-0.4 |
0.471 |
0 |
0 |
0 |
0.000 |
| 7 |
17 |
|
D |
3 |
1 |
10216 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
10406 |
45.2 |
1.1 |
0.901 |
0 |
0 |
0 |
0.000 |
18 |
|
C |
3 |
1 |
10392 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
10177 |
43.6 |
1.1 |
0.905 |
0 |
0 |
0 |
0.000 |
| Average: |
44.4 |
1.1 |
0.903 |
0 |
0 |
0 |
0.000 |
| 8 |
19 |
|
[MG]D:400 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
10216 |
42.6 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.096 |
| 9 |
20 |
|
[MG]D:400 |
1 |
1 |
98 |
f |
[TTP]D:303 |
x,y,z |
1_555 |
4 |
1 |
575 |
32.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.074 |
|