## |
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 |
288 |
71 |
10886 |
◊ |
A |
x,y,z |
1_555 |
300 |
73 |
10609 |
2871.3 |
-39.4 |
0.017 |
31 |
6 |
0 |
1.000 |
2 |
|
D |
285 |
70 |
10581 |
◊ |
C |
x,y,z |
1_555 |
290 |
68 |
10652 |
2702.7 |
-36.8 |
0.018 |
29 |
6 |
0 |
1.000 |
Average: |
2787.0 |
-38.1 |
0.018 |
30 |
6 |
0 |
1.000 |
2 |
3 |
|
D |
90 |
22 |
10581 |
◊ |
B |
x,y,z |
1_555 |
86 |
21 |
10886 |
860.7 |
-6.6 |
0.395 |
13 |
13 |
0 |
0.000 |
4 |
|
C |
90 |
22 |
10652 |
◊ |
A |
x,y,z |
1_555 |
87 |
22 |
10609 |
857.5 |
-6.8 |
0.388 |
13 |
12 |
0 |
0.000 |
Average: |
859.1 |
-6.7 |
0.392 |
13 |
13 |
0 |
0.000 |
3 |
5 |
|
B |
39 |
14 |
10886 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
29 |
10 |
10581 |
305.9 |
-0.7 |
0.622 |
1 |
0 |
0 |
0.000 |
4 |
6 |
|
D |
20 |
8 |
10581 |
◊ |
A |
x,y,z |
1_555 |
22 |
8 |
10609 |
211.2 |
4.1 |
0.962 |
2 |
4 |
0 |
0.000 |
7 |
|
C |
22 |
8 |
10652 |
◊ |
B |
x,y,z |
1_555 |
22 |
8 |
10886 |
199.1 |
4.2 |
0.952 |
2 |
4 |
0 |
0.000 |
Average: |
205.1 |
4.1 |
0.957 |
2 |
4 |
0 |
0.000 |
5 |
8 |
|
B |
19 |
6 |
10886 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
28 |
10 |
10581 |
197.8 |
1.9 |
0.784 |
4 |
4 |
0 |
0.000 |
6 |
9 |
|
B |
17 |
5 |
10886 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
16 |
7 |
10652 |
155.6 |
-0.9 |
0.508 |
2 |
0 |
0 |
0.000 |
7 |
10 |
|
B |
14 |
5 |
10886 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
15 |
4 |
10609 |
149.2 |
0.7 |
0.737 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
B |
10 |
3 |
10886 |
◊ |
C |
x,y-1,z |
1_545 |
17 |
6 |
10652 |
96.1 |
-1.3 |
0.372 |
0 |
0 |
0 |
0.000 |
9 |
12 |
|
[EDO]B:217 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
13 |
7 |
10886 |
88.7 |
1.9 |
0.231 |
1 |
0 |
0 |
0.000 |
10 |
13 |
|
A |
12 |
5 |
10609 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
11 |
4 |
10581 |
87.4 |
1.5 |
0.808 |
1 |
0 |
0 |
0.000 |
11 |
14 |
|
[EDO]C:216 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
14 |
5 |
10581 |
86.0 |
1.7 |
0.342 |
2 |
0 |
0 |
0.000 |
12 |
15 |
|
[EDO]D:217 |
4 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
16 |
4 |
10581 |
84.2 |
2.7 |
0.300 |
1 |
0 |
0 |
0.000 |
13 |
16 |
|
[EDO]B:216 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
14 |
5 |
10886 |
82.1 |
3.0 |
0.494 |
1 |
0 |
0 |
0.000 |
14 |
17 |
|
D |
11 |
5 |
10581 |
x |
D |
-x,y-1/2,-z |
2_545 |
8 |
3 |
10581 |
78.1 |
1.0 |
0.786 |
3 |
0 |
0 |
0.000 |
15 |
18 |
|
[EDO]B:218 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
15 |
5 |
10886 |
76.2 |
2.3 |
0.314 |
1 |
0 |
0 |
0.000 |
16 |
19 |
|
A |
10 |
4 |
10609 |
◊ |
C |
x,y-1,z |
1_545 |
11 |
5 |
10652 |
74.4 |
1.0 |
0.783 |
3 |
0 |
0 |
0.000 |
17 |
20 |
|
C |
6 |
3 |
10652 |
x |
C |
-x+1,y-1/2,-z |
2_645 |
10 |
4 |
10652 |
72.5 |
0.3 |
0.703 |
1 |
0 |
0 |
0.000 |
18 |
21 |
|
[EDO]D:218 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
14 |
6 |
10581 |
71.6 |
1.8 |
0.772 |
1 |
0 |
0 |
0.000 |
19 |
22 |
|
[EDO]B:220 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
14 |
5 |
10652 |
71.0 |
1.9 |
0.268 |
2 |
0 |
0 |
0.000 |
20 |
23 |
|
[EDO]A:216 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
9 |
3 |
10652 |
70.2 |
1.7 |
0.236 |
1 |
0 |
0 |
0.000 |
21 |
24 |
|
[EDO]B:220 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
11 |
5 |
10886 |
69.8 |
2.0 |
0.279 |
2 |
0 |
0 |
0.000 |
22 |
25 |
|
[EDO]A:216 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
10609 |
67.7 |
1.8 |
0.251 |
1 |
0 |
0 |
0.000 |
23 |
26 |
|
[EDO]C:216 |
3 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
10652 |
65.6 |
1.5 |
0.266 |
2 |
0 |
0 |
0.000 |
24 |
27 |
|
[EDO]D:216 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
11 |
4 |
10581 |
65.0 |
2.0 |
0.319 |
2 |
0 |
0 |
0.000 |
25 |
28 |
|
[EDO]B:219 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
10886 |
64.0 |
2.1 |
0.302 |
1 |
0 |
0 |
0.000 |
26 |
29 |
|
A |
8 |
4 |
10609 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
5 |
3 |
10609 |
57.1 |
0.5 |
0.608 |
0 |
0 |
0 |
0.000 |
27 |
30 |
|
B |
9 |
5 |
10886 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
10 |
5 |
10652 |
53.4 |
0.8 |
0.750 |
1 |
0 |
0 |
0.000 |
28 |
31 |
|
[EDO]B:219 |
4 |
1 |
185 |
f |
A |
x-1,y,z |
1_455 |
5 |
2 |
10609 |
51.4 |
1.1 |
0.623 |
1 |
0 |
0 |
0.000 |
29 |
32 |
|
B |
9 |
5 |
10886 |
◊ |
A |
x-1,y,z |
1_455 |
5 |
4 |
10609 |
48.5 |
0.4 |
0.729 |
0 |
0 |
0 |
0.000 |
30 |
33 |
|
D |
4 |
2 |
10581 |
◊ |
C |
x-1,y,z |
1_455 |
4 |
3 |
10652 |
44.8 |
1.2 |
0.885 |
1 |
0 |
0 |
0.000 |
31 |
34 |
|
[EDO]D:217 |
3 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
4 |
1 |
10886 |
44.0 |
1.2 |
0.835 |
1 |
0 |
0 |
0.000 |
32 |
35 |
|
[EDO]D:216 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
10652 |
43.8 |
0.3 |
0.611 |
1 |
0 |
0 |
0.003 |
33 |
36 |
|
A |
6 |
1 |
10609 |
◊ |
C |
-x+1,y-1/2,-z |
2_645 |
7 |
2 |
10652 |
40.1 |
-0.5 |
0.471 |
0 |
0 |
0 |
0.000 |
34 |
37 |
|
[EDO]D:216 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
10609 |
39.1 |
1.8 |
0.949 |
0 |
0 |
0 |
0.000 |
35 |
38 |
|
A |
6 |
4 |
10609 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
6 |
5 |
10652 |
38.0 |
0.5 |
0.741 |
0 |
0 |
0 |
0.000 |
36 |
39 |
|
[EDO]B:218 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
10609 |
36.7 |
0.2 |
0.497 |
0 |
0 |
0 |
0.000 |
37 |
40 |
|
[EDO]B:216 |
2 |
1 |
184 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
6 |
1 |
10581 |
35.2 |
0.6 |
0.675 |
0 |
0 |
0 |
0.000 |
38 |
41 |
|
[EDO]D:218 |
4 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
10652 |
32.9 |
1.3 |
0.954 |
0 |
0 |
0 |
0.000 |
39 |
42 |
|
[EDO]B:218 |
4 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
10581 |
32.7 |
1.4 |
0.934 |
0 |
0 |
0 |
0.000 |
40 |
43 |
|
[EDO]D:216 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
10886 |
32.7 |
0.9 |
0.867 |
1 |
0 |
0 |
0.000 |
41 |
44 |
|
[EDO]B:218 |
3 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
5 |
1 |
10652 |
28.4 |
1.3 |
0.940 |
0 |
0 |
0 |
0.000 |
42 |
45 |
|
D |
5 |
3 |
10581 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
6 |
3 |
10652 |
27.3 |
0.4 |
0.733 |
0 |
0 |
0 |
0.000 |
43 |
46 |
|
[EDO]B:216 |
1 |
1 |
184 |
f |
A |
x-1,y,z |
1_455 |
3 |
1 |
10609 |
20.7 |
0.5 |
0.890 |
1 |
0 |
0 |
0.000 |
44 |
47 |
|
D |
3 |
1 |
10581 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
10609 |
19.6 |
0.9 |
0.855 |
0 |
1 |
0 |
0.000 |
45 |
48 |
|
[EDO]D:218 |
2 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
3 |
2 |
10886 |
12.2 |
0.0 |
0.659 |
0 |
0 |
0 |
0.000 |
46 |
49 |
|
[EDO]B:217 |
2 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
10652 |
7.6 |
0.1 |
0.538 |
0 |
0 |
0 |
0.000 |
47 |
50 |
|
[EDO]D:216 |
1 |
1 |
185 |
f |
[EDO]A:216 |
x,y,z |
1_555 |
1 |
1 |
184 |
4.0 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
48 |
51 |
|
[EDO]B:220 |
2 |
1 |
185 |
f |
[EDO]B:218 |
x,y,z |
1_555 |
2 |
1 |
185 |
3.0 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
49 |
52 |
|
B |
1 |
1 |
10886 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
10609 |
2.3 |
-0.0 |
0.579 |
0 |
0 |
0 |
0.000 |
|