## |
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 |
|
N |
119 |
26 |
5912 |
◊ |
M |
x,y,z |
1_555 |
117 |
26 |
5849 |
1132.6 |
-14.1 |
0.738 |
77 |
0 |
0 |
1.000 |
2 |
2 |
|
C |
88 |
32 |
22560 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
90 |
32 |
22517 |
791.9 |
0.6 |
0.788 |
5 |
4 |
0 |
0.000 |
3 |
3 |
|
B |
63 |
18 |
9221 |
◊ |
A |
x,y,z |
1_555 |
48 |
14 |
5867 |
476.0 |
-0.4 |
0.720 |
11 |
4 |
0 |
0.000 |
4 |
|
E |
55 |
15 |
9213 |
◊ |
D |
x,y,z |
1_555 |
46 |
13 |
5873 |
442.3 |
-0.3 |
0.709 |
10 |
4 |
0 |
0.000 |
Average: |
459.2 |
-0.4 |
0.715 |
11 |
4 |
0 |
0.000 |
4 |
5 |
|
F |
60 |
16 |
22517 |
◊ |
E |
x,y,z |
1_555 |
36 |
8 |
9213 |
449.1 |
-8.4 |
0.068 |
0 |
0 |
0 |
0.000 |
6 |
|
C |
59 |
16 |
22560 |
◊ |
B |
x,y,z |
1_555 |
36 |
8 |
9221 |
447.5 |
-8.5 |
0.071 |
1 |
0 |
0 |
0.000 |
Average: |
448.3 |
-8.4 |
0.070 |
1 |
0 |
0 |
0.000 |
5 |
7 |
|
N |
39 |
4 |
5912 |
◊ |
A |
x,y,z |
1_555 |
39 |
14 |
5867 |
351.2 |
-2.5 |
0.641 |
8 |
0 |
0 |
0.000 |
6 |
8 |
|
M |
39 |
4 |
5849 |
◊ |
D |
x,y,z |
1_555 |
38 |
13 |
5873 |
342.7 |
-3.1 |
0.570 |
7 |
0 |
0 |
0.000 |
7 |
9 |
|
F |
28 |
10 |
22517 |
◊ |
D |
x,y,z |
1_555 |
28 |
6 |
5873 |
260.5 |
-2.8 |
0.282 |
7 |
3 |
0 |
0.000 |
10 |
|
C |
28 |
10 |
22560 |
◊ |
A |
x,y,z |
1_555 |
29 |
6 |
5867 |
259.4 |
-2.9 |
0.270 |
7 |
3 |
0 |
0.000 |
Average: |
259.9 |
-2.9 |
0.276 |
7 |
3 |
0 |
0.000 |
8 |
11 |
|
N |
22 |
3 |
5912 |
◊ |
F |
x,y,z |
1_555 |
27 |
9 |
22517 |
220.2 |
-1.6 |
0.617 |
3 |
0 |
0 |
0.000 |
9 |
12 |
|
M |
20 |
3 |
5849 |
◊ |
C |
x,y,z |
1_555 |
27 |
8 |
22560 |
217.1 |
-1.7 |
0.597 |
4 |
0 |
0 |
0.000 |
10 |
13 |
|
N |
27 |
6 |
5912 |
◊ |
E |
x-1,y,z |
1_455 |
25 |
8 |
9213 |
206.5 |
-7.8 |
0.295 |
2 |
0 |
0 |
0.000 |
11 |
14 |
|
C |
24 |
7 |
22560 |
x |
C |
x-1/2,-y+1/2,-z |
4_455 |
20 |
4 |
22560 |
201.7 |
0.1 |
0.549 |
1 |
2 |
0 |
0.000 |
12 |
15 |
|
B |
27 |
9 |
9221 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
23 |
9 |
22560 |
192.5 |
-1.2 |
0.562 |
2 |
0 |
0 |
0.000 |
13 |
16 |
|
B |
25 |
9 |
9221 |
◊ |
E |
x-1,y,z |
1_455 |
20 |
6 |
9213 |
182.3 |
-0.2 |
0.721 |
0 |
2 |
0 |
0.000 |
14 |
17 |
|
M |
26 |
5 |
5849 |
◊ |
A |
x,y,z |
1_555 |
21 |
6 |
5867 |
164.4 |
1.1 |
0.605 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
N |
24 |
4 |
5912 |
◊ |
D |
x,y,z |
1_555 |
18 |
4 |
5873 |
146.7 |
0.7 |
0.559 |
0 |
0 |
0 |
0.000 |
16 |
19 |
|
[EDO]C:1101 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
28 |
9 |
22560 |
132.6 |
3.2 |
0.618 |
5 |
0 |
0 |
0.000 |
17 |
20 |
|
F |
12 |
4 |
22517 |
◊ |
N |
-x+1,y-1/2,-z+1/2 |
3_645 |
19 |
5 |
5912 |
131.5 |
-0.9 |
0.504 |
1 |
0 |
0 |
0.000 |
18 |
21 |
|
C |
14 |
5 |
22560 |
◊ |
M |
x-1/2,-y+1/2,-z |
4_455 |
16 |
3 |
5849 |
131.2 |
-1.9 |
0.541 |
2 |
0 |
0 |
0.000 |
19 |
22 |
|
B |
12 |
4 |
9221 |
◊ |
M |
x-1,y,z |
1_455 |
20 |
4 |
5849 |
124.2 |
-2.5 |
0.552 |
4 |
0 |
0 |
0.000 |
20 |
23 |
|
A |
16 |
8 |
5867 |
◊ |
F |
-x+1/2,-y+1,z-1/2 |
2_564 |
15 |
6 |
22517 |
122.3 |
0.0 |
0.446 |
0 |
0 |
0 |
0.000 |
24 |
|
C |
14 |
6 |
22560 |
◊ |
D |
-x+1/2,-y+1,z-1/2 |
2_564 |
14 |
7 |
5873 |
100.5 |
-0.4 |
0.424 |
0 |
0 |
0 |
0.000 |
Average: |
111.4 |
-0.2 |
0.435 |
0 |
0 |
0 |
0.000 |
21 |
25 |
|
F |
6 |
2 |
22517 |
◊ |
M |
-x+1,y-1/2,-z+1/2 |
3_645 |
15 |
4 |
5849 |
107.1 |
1.2 |
0.813 |
1 |
0 |
0 |
0.000 |
22 |
26 |
|
N |
13 |
2 |
5912 |
◊ |
B |
x,y,z |
1_555 |
14 |
5 |
9221 |
94.3 |
-1.7 |
0.550 |
2 |
0 |
0 |
0.000 |
23 |
27 |
|
M |
10 |
2 |
5849 |
◊ |
E |
x,y,z |
1_555 |
10 |
4 |
9213 |
90.5 |
-2.2 |
0.450 |
3 |
0 |
0 |
0.000 |
24 |
28 |
|
C |
4 |
2 |
22560 |
◊ |
N |
x-1/2,-y+1/2,-z |
4_455 |
10 |
3 |
5912 |
60.8 |
-1.1 |
0.330 |
0 |
0 |
0 |
0.000 |
25 |
29 |
|
F |
10 |
3 |
22517 |
◊ |
D |
-x+1,y-1/2,-z+1/2 |
3_645 |
4 |
1 |
5873 |
57.2 |
0.1 |
0.615 |
2 |
0 |
0 |
0.000 |
26 |
30 |
|
[ZN]A:200 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
5867 |
49.0 |
-39.1 |
0.000 |
0 |
0 |
0 |
0.100 |
27 |
31 |
|
F |
7 |
2 |
22517 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
2 |
9221 |
42.8 |
0.3 |
0.726 |
0 |
0 |
0 |
0.000 |
28 |
32 |
|
B |
3 |
2 |
9221 |
◊ |
N |
x-1,y,z |
1_455 |
6 |
2 |
5912 |
38.4 |
-1.1 |
0.493 |
1 |
0 |
0 |
0.000 |
29 |
33 |
|
M |
8 |
4 |
5849 |
◊ |
E |
x-1,y,z |
1_455 |
5 |
3 |
9213 |
35.0 |
-1.2 |
0.526 |
0 |
0 |
0 |
0.000 |
30 |
34 |
|
F |
3 |
2 |
22517 |
◊ |
A |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
2 |
5867 |
30.4 |
0.8 |
0.664 |
0 |
1 |
0 |
0.000 |
31 |
35 |
|
B |
4 |
2 |
9221 |
◊ |
C |
x-1,y,z |
1_455 |
3 |
3 |
22560 |
25.8 |
1.0 |
0.836 |
1 |
1 |
0 |
0.000 |
36 |
|
F |
1 |
1 |
22517 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
9213 |
4.3 |
0.2 |
0.833 |
0 |
0 |
0 |
0.000 |
Average: |
15.0 |
0.6 |
0.835 |
1 |
1 |
0 |
0.000 |
32 |
37 |
|
M |
4 |
2 |
5849 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
9221 |
13.9 |
-0.3 |
0.590 |
0 |
0 |
0 |
0.000 |
33 |
38 |
|
N |
4 |
2 |
5912 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
9213 |
6.9 |
0.3 |
0.691 |
0 |
0 |
0 |
0.000 |
|