## |
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 |
185 |
52 |
11768 |
◊ |
A |
x,y,z |
1_555 |
188 |
54 |
11747 |
1709.0 |
-21.2 |
0.092 |
15 |
8 |
0 |
0.397 |
2 |
|
C |
186 |
54 |
11771 |
◊ |
C |
x,-y,-z |
4_555 |
186 |
54 |
11771 |
1676.8 |
-21.4 |
0.114 |
12 |
8 |
0 |
0.397 |
Average: |
1692.9 |
-21.3 |
0.103 |
14 |
8 |
0 |
0.397 |
2 |
3 |
|
A |
68 |
25 |
11747 |
◊ |
A |
-x+2,y,-z-1/2 |
3_754 |
66 |
25 |
11747 |
614.9 |
-3.6 |
0.537 |
8 |
2 |
0 |
0.045 |
3 |
4 |
|
C |
55 |
19 |
11771 |
◊ |
B |
x,-y,-z |
4_555 |
49 |
15 |
11768 |
495.5 |
-3.6 |
0.450 |
3 |
4 |
0 |
0.081 |
5 |
|
C |
43 |
13 |
11771 |
◊ |
A |
x,y,z |
1_555 |
50 |
17 |
11747 |
460.4 |
-4.1 |
0.381 |
1 |
2 |
0 |
0.081 |
Average: |
477.9 |
-3.8 |
0.415 |
2 |
3 |
0 |
0.081 |
4 |
6 |
|
B |
47 |
13 |
11768 |
◊ |
A |
-x+2,y,-z-1/2 |
3_754 |
44 |
14 |
11747 |
446.3 |
-3.3 |
0.435 |
3 |
2 |
0 |
0.059 |
5 |
7 |
|
C |
43 |
17 |
11771 |
◊ |
B |
x,y,z |
1_555 |
48 |
19 |
11768 |
445.7 |
-3.3 |
0.425 |
5 |
0 |
0 |
0.044 |
6 |
8 |
|
B |
25 |
6 |
11768 |
◊ |
C |
-x+5/2,-y+1/2,z-1/2 |
6_754 |
27 |
10 |
11771 |
258.5 |
-1.5 |
0.482 |
1 |
0 |
0 |
0.000 |
7 |
9 |
|
A |
27 |
10 |
11747 |
◊ |
C |
-x+5/2,-y+1/2,z-1/2 |
6_754 |
29 |
9 |
11771 |
258.0 |
-1.2 |
0.573 |
1 |
0 |
0 |
0.000 |
8 |
10 |
|
[C5P]B:303 |
21 |
1 |
442 |
f |
B |
x,y,z |
1_555 |
40 |
17 |
11768 |
239.6 |
3.5 |
0.888 |
8 |
0 |
0 |
0.000 |
11 |
|
[C5P]C:302 |
21 |
1 |
436 |
f |
C |
x,y,z |
1_555 |
36 |
16 |
11771 |
236.9 |
3.9 |
0.898 |
8 |
0 |
0 |
0.000 |
12 |
|
[C5P]A:701 |
20 |
1 |
444 |
f |
A |
x,y,z |
1_555 |
37 |
16 |
11747 |
234.1 |
3.7 |
0.905 |
8 |
0 |
0 |
0.000 |
Average: |
236.9 |
3.7 |
0.897 |
8 |
0 |
0 |
0.000 |
9 |
13 |
|
[DAN]A:703 |
14 |
1 |
447 |
◊ |
B |
x,y,z |
1_555 |
26 |
16 |
11768 |
175.9 |
1.0 |
0.657 |
5 |
0 |
0 |
0.036 |
14 |
|
[DAN]B:301 |
13 |
1 |
442 |
◊ |
A |
x,y,z |
1_555 |
27 |
16 |
11747 |
166.8 |
0.8 |
0.648 |
5 |
0 |
0 |
0.036 |
15 |
|
[DAN]C:301 |
13 |
1 |
447 |
◊ |
C |
x,y,z |
1_555 |
26 |
15 |
11771 |
163.7 |
1.1 |
0.683 |
4 |
0 |
0 |
0.036 |
Average: |
168.8 |
1.0 |
0.663 |
5 |
0 |
0 |
0.036 |
10 |
16 |
|
[DAN]C:301 |
16 |
1 |
447 |
f |
C |
x,-y,-z |
4_555 |
27 |
8 |
11771 |
157.3 |
-0.7 |
0.523 |
5 |
0 |
0 |
0.081 |
17 |
|
[DAN]B:301 |
16 |
1 |
442 |
f |
B |
x,y,z |
1_555 |
26 |
8 |
11768 |
154.1 |
-0.6 |
0.501 |
6 |
0 |
0 |
0.081 |
18 |
|
[DAN]A:703 |
15 |
1 |
447 |
f |
A |
x,y,z |
1_555 |
26 |
8 |
11747 |
152.4 |
-0.5 |
0.533 |
5 |
0 |
0 |
0.081 |
Average: |
154.6 |
-0.6 |
0.519 |
5 |
0 |
0 |
0.081 |
11 |
19 |
|
B |
17 |
6 |
11768 |
◊ |
A |
-x+5/2,-y+1/2,z-1/2 |
6_754 |
11 |
4 |
11747 |
135.3 |
-3.0 |
0.110 |
0 |
0 |
0 |
0.000 |
12 |
20 |
|
[FLC]B:302 |
11 |
1 |
311 |
◊ |
B |
x,y,z |
1_555 |
20 |
6 |
11768 |
128.8 |
-0.8 |
0.351 |
2 |
0 |
0 |
0.023 |
13 |
21 |
|
[FLC]B:302 |
9 |
1 |
311 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
11747 |
121.3 |
0.2 |
0.550 |
5 |
0 |
0 |
0.028 |
14 |
22 |
|
B |
17 |
7 |
11768 |
x |
B |
-x+5/2,-y+1/2,z-1/2 |
6_754 |
11 |
4 |
11768 |
104.1 |
1.2 |
0.791 |
1 |
1 |
0 |
0.000 |
15 |
23 |
|
[FLC]C:303 |
10 |
1 |
306 |
f |
C |
x,-y,-z |
4_555 |
18 |
5 |
11771 |
102.8 |
-0.6 |
0.408 |
5 |
0 |
0 |
0.075 |
16 |
24 |
|
[FLC]C:303 |
9 |
1 |
306 |
◊ |
C |
x,y,z |
1_555 |
18 |
5 |
11771 |
96.0 |
-0.5 |
0.437 |
4 |
0 |
0 |
0.061 |
17 |
25 |
|
[FLC]C:303 |
10 |
1 |
306 |
◊ |
[FLC]C:303 |
x,-y,-z |
4_555 |
10 |
1 |
306 |
85.6 |
0.6 |
0.437 |
0 |
0 |
0 |
0.000 |
18 |
26 |
|
[DAN]B:301 |
12 |
1 |
442 |
◊ |
[C5P]A:701 |
x,y,z |
1_555 |
8 |
1 |
444 |
75.2 |
-0.9 |
0.484 |
1 |
0 |
0 |
0.041 |
27 |
|
[DAN]A:703 |
12 |
1 |
447 |
◊ |
[C5P]B:303 |
x,y,z |
1_555 |
8 |
1 |
442 |
75.0 |
-1.0 |
0.474 |
1 |
0 |
0 |
0.041 |
28 |
|
[DAN]C:301 |
10 |
1 |
447 |
◊ |
[C5P]C:302 |
x,y,z |
1_555 |
7 |
1 |
436 |
73.8 |
-1.1 |
0.419 |
1 |
0 |
0 |
0.041 |
Average: |
74.7 |
-1.0 |
0.459 |
1 |
0 |
0 |
0.041 |
19 |
29 |
|
[CL]C:304 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
9 |
6 |
11771 |
63.9 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.223 |
30 |
|
[CL]A:702 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
11747 |
63.6 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.223 |
31 |
|
[CL]B:304 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
11768 |
60.8 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.223 |
Average: |
62.8 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.223 |
20 |
32 |
|
[C5P]A:701 |
4 |
1 |
444 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
11768 |
41.7 |
-0.9 |
0.441 |
3 |
0 |
0 |
0.055 |
33 |
|
[C5P]C:302 |
4 |
1 |
436 |
◊ |
C |
x,-y,-z |
4_555 |
5 |
3 |
11771 |
35.8 |
-0.8 |
0.455 |
3 |
0 |
0 |
0.055 |
34 |
|
[C5P]B:303 |
4 |
1 |
442 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
11747 |
34.0 |
-0.6 |
0.513 |
2 |
0 |
0 |
0.055 |
Average: |
37.2 |
-0.8 |
0.470 |
3 |
0 |
0 |
0.055 |
21 |
35 |
|
[CL]B:304 |
1 |
1 |
125 |
f |
[C5P]B:303 |
x,y,z |
1_555 |
7 |
1 |
442 |
36.6 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.126 |
36 |
|
[CL]C:304 |
1 |
1 |
125 |
f |
[C5P]C:302 |
x,y,z |
1_555 |
5 |
1 |
436 |
32.2 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.126 |
37 |
|
[CL]A:702 |
1 |
1 |
125 |
f |
[C5P]A:701 |
x,y,z |
1_555 |
5 |
1 |
444 |
31.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.126 |
Average: |
33.3 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.126 |
22 |
38 |
|
B |
3 |
1 |
11768 |
◊ |
C |
x,y,z-1 |
1_554 |
2 |
1 |
11771 |
19.1 |
0.3 |
0.751 |
0 |
0 |
0 |
0.000 |
23 |
39 |
|
A |
2 |
1 |
11747 |
◊ |
A |
-x+2,y,-z+1/2 |
3_755 |
2 |
1 |
11747 |
15.3 |
0.4 |
0.802 |
0 |
0 |
0 |
0.000 |
24 |
40 |
|
[DAN]B:301 |
1 |
1 |
442 |
◊ |
A |
-x+2,y,-z-1/2 |
3_754 |
1 |
1 |
11747 |
7.0 |
-0.1 |
0.425 |
0 |
0 |
0 |
0.000 |
25 |
41 |
|
[C5P]A:701 |
1 |
1 |
444 |
◊ |
A |
-x+2,y,-z-1/2 |
3_754 |
1 |
1 |
11747 |
5.7 |
-0.1 |
0.469 |
0 |
0 |
0 |
0.000 |
|