## |
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 |
|
C |
60 |
18 |
15340 |
◊ |
A |
x,y,z |
1_555 |
63 |
20 |
15498 |
569.9 |
5.6 |
0.904 |
12 |
15 |
0 |
0.000 |
2 |
|
C |
62 |
21 |
15340 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
52 |
16 |
15372 |
515.0 |
4.3 |
0.838 |
14 |
16 |
0 |
0.000 |
3 |
|
D |
45 |
12 |
15422 |
◊ |
B |
x,y,z |
1_555 |
60 |
19 |
15372 |
460.6 |
4.7 |
0.825 |
12 |
11 |
0 |
0.000 |
4 |
|
D |
55 |
19 |
15422 |
◊ |
A |
x,y,z |
1_555 |
44 |
14 |
15498 |
437.8 |
3.2 |
0.775 |
9 |
11 |
0 |
0.000 |
Average: |
495.8 |
4.4 |
0.835 |
12 |
13 |
0 |
0.000 |
2 |
5 |
|
[BH3]D:401 |
27 |
1 |
726 |
f |
D |
x,y,z |
1_555 |
71 |
29 |
15422 |
475.4 |
-6.7 |
0.399 |
8 |
0 |
0 |
0.100 |
6 |
|
[BH3]A:401 |
27 |
1 |
732 |
f |
A |
x,y,z |
1_555 |
75 |
30 |
15498 |
460.3 |
-7.0 |
0.381 |
7 |
0 |
0 |
0.100 |
7 |
|
[BH3]B:401 |
27 |
1 |
731 |
f |
B |
x,y,z |
1_555 |
74 |
29 |
15372 |
453.3 |
-6.5 |
0.403 |
6 |
0 |
0 |
0.100 |
8 |
|
[BH3]C:401 |
26 |
1 |
733 |
f |
C |
x,y,z |
1_555 |
73 |
26 |
15340 |
451.7 |
-6.8 |
0.385 |
5 |
0 |
0 |
0.100 |
Average: |
460.2 |
-6.8 |
0.392 |
7 |
0 |
0 |
0.100 |
3 |
9 |
|
B |
36 |
9 |
15372 |
◊ |
A |
x-1/2,-y-1/2,-z |
3_445 |
44 |
14 |
15498 |
341.3 |
-1.3 |
0.456 |
2 |
6 |
0 |
0.000 |
4 |
10 |
|
A |
35 |
12 |
15498 |
x |
A |
x-1/2,-y-1/2,-z |
3_445 |
28 |
8 |
15498 |
325.9 |
-3.1 |
0.244 |
1 |
1 |
0 |
0.000 |
5 |
11 |
|
C |
32 |
13 |
15340 |
◊ |
D |
x-1/2,-y+1/2,-z |
3_455 |
29 |
11 |
15422 |
234.9 |
-2.1 |
0.302 |
0 |
0 |
0 |
0.000 |
6 |
12 |
|
B |
25 |
9 |
15372 |
◊ |
C |
x-1/2,-y+1/2,-z |
3_455 |
22 |
8 |
15340 |
209.3 |
-0.3 |
0.512 |
4 |
0 |
0 |
0.000 |
7 |
13 |
|
D |
25 |
7 |
15422 |
◊ |
C |
x,y,z |
1_555 |
22 |
7 |
15340 |
183.5 |
1.3 |
0.732 |
1 |
0 |
0 |
0.000 |
14 |
|
A |
23 |
5 |
15498 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
16 |
5 |
15372 |
165.5 |
1.2 |
0.715 |
2 |
0 |
0 |
0.000 |
15 |
|
C |
24 |
5 |
15340 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
14 |
5 |
15422 |
155.1 |
2.0 |
0.750 |
1 |
0 |
0 |
0.000 |
16 |
|
B |
20 |
5 |
15372 |
◊ |
A |
x,y,z |
1_555 |
16 |
4 |
15498 |
133.9 |
1.8 |
0.785 |
1 |
0 |
0 |
0.000 |
Average: |
159.5 |
1.6 |
0.746 |
1 |
0 |
0 |
0.000 |
8 |
17 |
|
A |
30 |
9 |
15498 |
◊ |
C |
-x,y-1/2,-z-1/2 |
4_544 |
26 |
9 |
15340 |
182.7 |
2.1 |
0.793 |
0 |
1 |
0 |
0.000 |
9 |
18 |
|
C |
3 |
1 |
15340 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
15372 |
41.4 |
0.9 |
0.819 |
0 |
3 |
0 |
0.000 |
19 |
|
C |
2 |
1 |
15340 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
15498 |
7.0 |
0.3 |
0.826 |
0 |
0 |
0 |
0.000 |
20 |
|
A |
1 |
1 |
15498 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
15422 |
0.8 |
0.0 |
0.628 |
0 |
0 |
0 |
0.000 |
Average: |
16.4 |
0.4 |
0.758 |
0 |
1 |
0 |
0.000 |
10 |
21 |
|
B |
7 |
2 |
15372 |
◊ |
D |
x-1,y,z |
1_455 |
3 |
2 |
15422 |
28.9 |
0.2 |
0.643 |
0 |
0 |
0 |
0.000 |
11 |
22 |
|
D |
4 |
2 |
15422 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
5 |
4 |
15372 |
18.1 |
0.4 |
0.673 |
0 |
0 |
0 |
0.000 |
12 |
23 |
|
B |
2 |
1 |
15372 |
◊ |
D |
x-1/2,-y+1/2,-z |
3_455 |
1 |
1 |
15422 |
15.2 |
-0.3 |
0.252 |
0 |
0 |
0 |
0.000 |
13 |
24 |
|
C |
2 |
1 |
15340 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
1 |
1 |
15372 |
9.1 |
0.2 |
0.569 |
0 |
0 |
0 |
0.000 |
14 |
25 |
|
D |
1 |
1 |
15422 |
x |
D |
x-1/2,-y+1/2,-z |
3_455 |
3 |
2 |
15422 |
5.1 |
-0.1 |
0.445 |
0 |
0 |
0 |
0.000 |
|