## |
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 |
79 |
24 |
17612 |
◊ |
A |
-x+1,-x+y,-z+1/3 |
9_655 |
89 |
27 |
17561 |
687.7 |
-3.0 |
0.305 |
9 |
4 |
0 |
0.000 |
2 |
2 |
|
B |
78 |
32 |
17612 |
◊ |
A |
x,y,z |
1_555 |
60 |
21 |
17561 |
604.2 |
2.0 |
0.683 |
7 |
2 |
0 |
0.000 |
3 |
3 |
|
B |
71 |
22 |
17612 |
◊ |
B |
-y+1,-x+1,-z+1/6 |
10_665 |
71 |
22 |
17612 |
590.6 |
-4.5 |
0.196 |
14 |
0 |
0 |
0.000 |
4 |
4 |
|
B |
32 |
11 |
17612 |
◊ |
A |
-y+1,-x+1,-z+1/6 |
10_665 |
27 |
11 |
17561 |
244.2 |
-0.0 |
0.529 |
5 |
3 |
0 |
0.000 |
5 |
5 |
|
C |
14 |
2 |
416 |
◊ |
A |
x,y,z |
1_555 |
33 |
13 |
17561 |
210.0 |
-0.4 |
0.557 |
5 |
2 |
0 |
0.118 |
6 |
6 |
|
D |
13 |
2 |
415 |
◊ |
B |
x,y,z |
1_555 |
38 |
16 |
17612 |
206.9 |
-0.7 |
0.525 |
4 |
1 |
0 |
0.108 |
7 |
7 |
|
[BOR]C:4 |
12 |
1 |
371 |
cf |
A |
x,y,z |
1_555 |
31 |
16 |
17561 |
205.4 |
1.4 |
0.470 |
7 |
0 |
0 |
0.072 |
8 |
8 |
|
[BOR]D:4 |
12 |
1 |
372 |
cf |
B |
x,y,z |
1_555 |
33 |
18 |
17612 |
192.5 |
1.4 |
0.490 |
7 |
0 |
0 |
0.068 |
9 |
9 |
|
B |
19 |
6 |
17612 |
◊ |
B |
-x+y,y,-z+1/2 |
11_555 |
20 |
7 |
17612 |
169.8 |
0.1 |
0.556 |
0 |
0 |
0 |
0.000 |
10 |
10 |
|
[NAG]A:604 |
10 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
13 |
4 |
17561 |
108.3 |
3.1 |
0.344 |
2 |
0 |
0 |
0.000 |
11 |
|
[NAG]B:604 |
10 |
1 |
365 |
cf |
B |
x,y,z |
1_555 |
12 |
4 |
17612 |
107.5 |
3.1 |
0.362 |
2 |
0 |
0 |
0.000 |
Average: |
107.9 |
3.1 |
0.353 |
2 |
0 |
0 |
0.000 |
11 |
12 |
|
A |
13 |
7 |
17561 |
◊ |
A |
-y+2,-x+2,-z+1/6 |
10_775 |
13 |
7 |
17561 |
106.1 |
1.5 |
0.791 |
0 |
0 |
0 |
0.000 |
12 |
13 |
|
[NAG]A:603 |
9 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
11 |
4 |
17561 |
105.4 |
2.6 |
0.371 |
0 |
0 |
0 |
0.000 |
13 |
14 |
|
[NAG]B:603 |
10 |
1 |
359 |
cf |
B |
x,y,z |
1_555 |
12 |
5 |
17612 |
105.4 |
2.5 |
0.333 |
0 |
0 |
0 |
0.000 |
14 |
15 |
|
[NAG]B:605 |
9 |
1 |
364 |
cf |
[NAG]B:604 |
x,y,z |
1_555 |
8 |
1 |
365 |
82.6 |
2.1 |
0.099 |
0 |
0 |
0 |
0.000 |
16 |
|
[NAG]A:605 |
9 |
1 |
360 |
cf |
[NAG]A:604 |
x,y,z |
1_555 |
9 |
1 |
364 |
79.6 |
2.5 |
0.076 |
0 |
0 |
0 |
0.000 |
Average: |
81.1 |
2.3 |
0.087 |
0 |
0 |
0 |
0.000 |
15 |
17 |
|
[ACE]C:1 |
3 |
1 |
173 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
17561 |
65.9 |
-1.1 |
0.551 |
0 |
0 |
0 |
0.045 |
16 |
18 |
|
[ACE]D:1 |
3 |
1 |
171 |
◊ |
B |
x,y,z |
1_555 |
12 |
4 |
17612 |
65.8 |
-1.1 |
0.559 |
0 |
0 |
0 |
0.043 |
17 |
19 |
|
[BOR]C:4 |
6 |
1 |
371 |
c |
C |
x,y,z |
1_555 |
6 |
2 |
416 |
65.0 |
-0.2 |
0.452 |
0 |
0 |
0 |
0.009 |
18 |
20 |
|
[BOR]D:4 |
8 |
1 |
372 |
c |
D |
x,y,z |
1_555 |
5 |
2 |
415 |
61.7 |
-0.3 |
0.420 |
0 |
0 |
0 |
0.010 |
19 |
21 |
|
[ACE]C:1 |
3 |
1 |
173 |
cf |
C |
x,y,z |
1_555 |
6 |
2 |
416 |
56.1 |
-0.5 |
0.715 |
0 |
0 |
0 |
0.100 |
20 |
22 |
|
[ACE]D:1 |
3 |
1 |
171 |
cf |
D |
x,y,z |
1_555 |
6 |
2 |
415 |
55.4 |
-0.5 |
0.722 |
0 |
0 |
0 |
0.100 |
21 |
23 |
|
[CA]B:600 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
14 |
10 |
17612 |
46.1 |
-10.9 |
0.000 |
0 |
0 |
0 |
0.451 |
24 |
|
[CA]A:600 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
13 |
9 |
17561 |
44.6 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.451 |
Average: |
45.4 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.451 |
22 |
25 |
|
[CA]B:602 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
17612 |
44.1 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.519 |
26 |
|
[CA]A:602 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
17561 |
43.6 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.519 |
Average: |
43.8 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.519 |
23 |
27 |
|
[BOR]D:4 |
3 |
1 |
372 |
◊ |
A |
-x+1,-x+y,-z+1/3 |
9_655 |
4 |
1 |
17561 |
28.2 |
0.0 |
0.441 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
C |
6 |
1 |
416 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
17612 |
26.3 |
0.3 |
0.707 |
0 |
0 |
0 |
0.000 |
25 |
29 |
|
[BOR]C:4 |
2 |
1 |
371 |
f |
[CA]A:600 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.7 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.067 |
30 |
|
[BOR]D:4 |
2 |
1 |
372 |
f |
[CA]B:600 |
x,y,z |
1_555 |
1 |
1 |
85 |
12.7 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.067 |
Average: |
12.7 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.067 |
26 |
31 |
|
D |
1 |
1 |
415 |
◊ |
A |
-x+1,-x+y,-z+1/3 |
9_655 |
1 |
1 |
17561 |
4.7 |
0.1 |
0.740 |
0 |
0 |
0 |
0.000 |
27 |
32 |
|
B |
2 |
2 |
17612 |
◊ |
B |
-x,-x+y,-z+1/3 |
9_555 |
2 |
2 |
17612 |
3.9 |
0.1 |
0.687 |
0 |
0 |
0 |
0.000 |
|