## |
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 |
|
F |
334 |
21 |
5051 |
◊ |
H |
x,y,z |
1_555 |
321 |
21 |
5043 |
1916.3 |
-35.9 |
0.842 |
3 |
0 |
0 |
0.000 |
2 |
|
G |
335 |
21 |
5045 |
◊ |
E |
x,y,z |
1_555 |
339 |
21 |
5036 |
1916.3 |
-35.6 |
0.880 |
3 |
0 |
0 |
0.000 |
Average: |
1916.3 |
-35.8 |
0.861 |
3 |
0 |
0 |
0.000 |
2 |
3 |
|
C |
171 |
42 |
24765 |
◊ |
A |
x,y,z |
1_555 |
169 |
44 |
24985 |
1680.9 |
-16.6 |
0.050 |
17 |
14 |
0 |
0.000 |
3 |
4 |
|
D |
160 |
44 |
13980 |
◊ |
C |
x,y,z |
1_555 |
144 |
31 |
24765 |
1453.4 |
-24.6 |
0.002 |
8 |
7 |
0 |
0.000 |
5 |
|
B |
162 |
46 |
13726 |
◊ |
A |
x,y,z |
1_555 |
142 |
31 |
24985 |
1448.5 |
-23.8 |
0.004 |
10 |
7 |
0 |
0.000 |
Average: |
1450.9 |
-24.2 |
0.003 |
9 |
7 |
0 |
0.000 |
4 |
6 |
|
D |
100 |
28 |
13980 |
◊ |
A |
x,y,z |
1_555 |
100 |
32 |
24985 |
825.4 |
0.2 |
0.508 |
7 |
7 |
0 |
0.000 |
7 |
|
B |
97 |
27 |
13726 |
◊ |
C |
x,y,z |
1_555 |
97 |
28 |
24765 |
776.4 |
0.3 |
0.548 |
5 |
8 |
0 |
0.000 |
Average: |
800.9 |
0.3 |
0.528 |
6 |
8 |
0 |
0.000 |
5 |
8 |
|
G |
87 |
20 |
5045 |
◊ |
F |
x,y,z |
1_555 |
86 |
20 |
5051 |
708.0 |
-9.2 |
0.683 |
19 |
0 |
0 |
0.000 |
6 |
9 |
|
G |
90 |
20 |
5045 |
◊ |
H |
x,y,z |
1_555 |
90 |
20 |
5043 |
701.9 |
-11.2 |
0.674 |
33 |
0 |
0 |
0.000 |
10 |
|
F |
87 |
20 |
5051 |
◊ |
E |
x,y,z |
1_555 |
88 |
20 |
5036 |
676.5 |
-11.1 |
0.661 |
27 |
0 |
0 |
0.000 |
Average: |
689.2 |
-11.1 |
0.667 |
30 |
0 |
0 |
0.000 |
7 |
11 |
|
H |
90 |
20 |
5043 |
◊ |
E |
x,y,z |
1_555 |
89 |
20 |
5036 |
669.7 |
-9.9 |
0.739 |
20 |
0 |
0 |
0.000 |
8 |
12 |
|
D |
41 |
9 |
13980 |
◊ |
A |
x,y-1,z |
1_545 |
53 |
14 |
24985 |
474.2 |
2.7 |
0.761 |
1 |
3 |
0 |
0.000 |
13 |
|
C |
54 |
15 |
24765 |
◊ |
B |
x,y-1,z |
1_545 |
43 |
9 |
13726 |
474.1 |
2.1 |
0.726 |
2 |
4 |
0 |
0.000 |
Average: |
474.2 |
2.4 |
0.744 |
2 |
4 |
0 |
0.000 |
9 |
14 |
|
F |
67 |
7 |
5051 |
◊ |
C |
x,y,z |
1_555 |
74 |
23 |
24765 |
414.3 |
-3.2 |
0.524 |
1 |
0 |
0 |
0.000 |
15 |
|
G |
64 |
7 |
5045 |
◊ |
A |
x,y,z |
1_555 |
73 |
23 |
24985 |
391.3 |
-2.8 |
0.545 |
3 |
0 |
0 |
0.000 |
Average: |
402.8 |
-3.0 |
0.534 |
2 |
0 |
0 |
0.000 |
10 |
16 |
|
E |
66 |
7 |
5036 |
◊ |
A |
x,y,z |
1_555 |
75 |
22 |
24985 |
411.2 |
-2.8 |
0.583 |
3 |
0 |
0 |
0.000 |
17 |
|
H |
63 |
7 |
5043 |
◊ |
C |
x,y,z |
1_555 |
72 |
23 |
24765 |
381.4 |
-3.3 |
0.517 |
3 |
0 |
0 |
0.000 |
Average: |
396.3 |
-3.0 |
0.550 |
3 |
0 |
0 |
0.000 |
11 |
18 |
|
G |
68 |
11 |
5045 |
◊ |
C |
x,y,z |
1_555 |
52 |
21 |
24765 |
408.0 |
-5.0 |
0.282 |
4 |
0 |
0 |
0.000 |
19 |
|
F |
69 |
11 |
5051 |
◊ |
A |
x,y,z |
1_555 |
50 |
22 |
24985 |
378.3 |
-4.6 |
0.326 |
2 |
0 |
0 |
0.000 |
Average: |
393.2 |
-4.8 |
0.304 |
3 |
0 |
0 |
0.000 |
12 |
20 |
|
H |
68 |
11 |
5043 |
◊ |
A |
x,y,z |
1_555 |
52 |
22 |
24985 |
402.9 |
-3.7 |
0.358 |
2 |
0 |
0 |
0.000 |
21 |
|
E |
66 |
11 |
5036 |
◊ |
C |
x,y,z |
1_555 |
54 |
21 |
24765 |
394.0 |
-4.4 |
0.324 |
4 |
0 |
0 |
0.000 |
Average: |
398.4 |
-4.1 |
0.341 |
3 |
0 |
0 |
0.000 |
13 |
22 |
|
D |
31 |
10 |
13980 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
30 |
10 |
24985 |
300.5 |
0.4 |
0.543 |
1 |
1 |
0 |
0.000 |
23 |
|
C |
30 |
10 |
24765 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
32 |
10 |
13726 |
294.2 |
0.2 |
0.546 |
2 |
1 |
0 |
0.000 |
Average: |
297.3 |
0.3 |
0.544 |
2 |
1 |
0 |
0.000 |
14 |
24 |
|
H |
48 |
6 |
5043 |
◊ |
B |
x,y,z |
1_555 |
50 |
19 |
13726 |
299.7 |
-4.8 |
0.405 |
6 |
0 |
0 |
0.000 |
25 |
|
E |
47 |
6 |
5036 |
◊ |
D |
x,y,z |
1_555 |
51 |
19 |
13980 |
285.8 |
-5.6 |
0.313 |
5 |
0 |
0 |
0.000 |
Average: |
292.7 |
-5.2 |
0.359 |
6 |
0 |
0 |
0.000 |
15 |
26 |
|
G |
49 |
6 |
5045 |
◊ |
D |
x,y,z |
1_555 |
50 |
19 |
13980 |
296.3 |
-5.9 |
0.303 |
5 |
0 |
0 |
0.000 |
27 |
|
F |
49 |
6 |
5051 |
◊ |
B |
x,y,z |
1_555 |
50 |
19 |
13726 |
286.6 |
-4.5 |
0.371 |
6 |
0 |
0 |
0.000 |
Average: |
291.4 |
-5.2 |
0.337 |
6 |
0 |
0 |
0.000 |
16 |
28 |
|
A |
30 |
7 |
24985 |
◊ |
A |
x-1,y,z |
1_455 |
31 |
6 |
24985 |
251.2 |
0.2 |
0.485 |
0 |
1 |
0 |
0.000 |
17 |
29 |
|
E |
32 |
6 |
5036 |
◊ |
B |
x,y,z |
1_555 |
32 |
11 |
13726 |
185.0 |
-0.1 |
0.691 |
0 |
0 |
0 |
0.000 |
30 |
|
H |
32 |
6 |
5043 |
◊ |
D |
x,y,z |
1_555 |
30 |
11 |
13980 |
157.4 |
0.5 |
0.692 |
1 |
0 |
0 |
0.000 |
Average: |
171.2 |
0.2 |
0.692 |
1 |
0 |
0 |
0.000 |
18 |
31 |
|
G |
30 |
6 |
5045 |
◊ |
B |
x,y,z |
1_555 |
32 |
12 |
13726 |
184.8 |
-0.0 |
0.686 |
1 |
0 |
0 |
0.000 |
32 |
|
F |
30 |
6 |
5051 |
◊ |
D |
x,y,z |
1_555 |
33 |
13 |
13980 |
163.9 |
0.8 |
0.692 |
1 |
0 |
0 |
0.000 |
Average: |
174.3 |
0.4 |
0.689 |
1 |
0 |
0 |
0.000 |
19 |
33 |
|
[MFX]H:101 |
22 |
1 |
568 |
◊ |
E |
x,y,z |
1_555 |
24 |
3 |
5036 |
117.6 |
-0.3 |
0.668 |
0 |
0 |
0 |
0.000 |
34 |
|
[MFX]G:101 |
22 |
1 |
563 |
◊ |
H |
x,y,z |
1_555 |
25 |
3 |
5043 |
114.9 |
-0.2 |
0.674 |
0 |
0 |
0 |
0.000 |
Average: |
116.3 |
-0.2 |
0.671 |
0 |
0 |
0 |
0.000 |
20 |
35 |
|
[MFX]H:101 |
21 |
1 |
568 |
◊ |
G |
x,y,z |
1_555 |
24 |
3 |
5045 |
116.3 |
0.2 |
0.669 |
0 |
0 |
0 |
0.000 |
36 |
|
[MFX]G:101 |
21 |
1 |
563 |
◊ |
F |
x,y,z |
1_555 |
25 |
3 |
5051 |
111.7 |
0.2 |
0.687 |
0 |
0 |
0 |
0.000 |
Average: |
114.0 |
0.2 |
0.678 |
0 |
0 |
0 |
0.000 |
21 |
37 |
|
[MFX]H:101 |
18 |
1 |
568 |
◊ |
H |
x,y,z |
1_555 |
20 |
2 |
5043 |
107.0 |
0.6 |
0.773 |
0 |
0 |
0 |
0.000 |
38 |
|
[MFX]G:101 |
19 |
1 |
563 |
◊ |
E |
x,y,z |
1_555 |
19 |
2 |
5036 |
96.0 |
0.1 |
0.753 |
0 |
0 |
0 |
0.000 |
Average: |
101.5 |
0.4 |
0.763 |
0 |
0 |
0 |
0.000 |
22 |
39 |
|
[MFX]G:101 |
18 |
1 |
563 |
◊ |
G |
x,y,z |
1_555 |
20 |
2 |
5045 |
104.8 |
1.1 |
0.765 |
0 |
0 |
0 |
0.000 |
40 |
|
[MFX]H:101 |
17 |
1 |
568 |
◊ |
F |
x,y,z |
1_555 |
20 |
2 |
5051 |
91.8 |
1.0 |
0.791 |
0 |
0 |
0 |
0.000 |
Average: |
98.3 |
1.1 |
0.778 |
0 |
0 |
0 |
0.000 |
23 |
41 |
|
[MFX]G:101 |
11 |
1 |
563 |
◊ |
D |
x,y,z |
1_555 |
18 |
6 |
13980 |
85.9 |
-0.5 |
0.460 |
0 |
0 |
0 |
0.000 |
42 |
|
[MFX]H:101 |
10 |
1 |
568 |
◊ |
B |
x,y,z |
1_555 |
19 |
6 |
13726 |
84.6 |
-0.5 |
0.427 |
0 |
0 |
0 |
0.000 |
Average: |
85.2 |
-0.5 |
0.443 |
0 |
0 |
0 |
0.000 |
24 |
43 |
|
D |
8 |
4 |
13980 |
◊ |
B |
x,y-1,z |
1_545 |
9 |
4 |
13726 |
72.9 |
-0.2 |
0.555 |
0 |
0 |
0 |
0.000 |
25 |
44 |
|
[MFX]H:101 |
6 |
1 |
568 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
24765 |
45.3 |
-0.8 |
0.391 |
1 |
0 |
0 |
0.000 |
45 |
|
[MFX]G:101 |
7 |
1 |
563 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
24985 |
44.9 |
-0.8 |
0.343 |
1 |
0 |
0 |
0.000 |
Average: |
45.1 |
-0.8 |
0.367 |
1 |
0 |
0 |
0.000 |
26 |
46 |
|
[MG]B:701 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
7 |
5 |
13726 |
42.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
47 |
|
[MG]D:701 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
5 |
5 |
13980 |
41.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
42.1 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
48 |
|
[MFX]H:101 |
4 |
1 |
568 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
24985 |
34.5 |
-0.0 |
0.535 |
0 |
0 |
0 |
0.000 |
49 |
|
[MFX]G:101 |
4 |
1 |
563 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
24765 |
33.5 |
-0.1 |
0.524 |
0 |
0 |
0 |
0.000 |
Average: |
34.0 |
-0.0 |
0.529 |
0 |
0 |
0 |
0.000 |
28 |
50 |
|
[MFX]H:101 |
3 |
1 |
568 |
◊ |
[MG]A:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
22.0 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.000 |
51 |
|
[MFX]G:101 |
3 |
1 |
563 |
◊ |
[MG]C:601 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.3 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
21.7 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
29 |
52 |
|
[MG]A:601 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
24985 |
20.2 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.000 |
53 |
|
[MG]C:601 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
24765 |
19.9 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
20.1 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.000 |
30 |
54 |
|
[MG]C:601 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
6 |
3 |
5051 |
18.5 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
55 |
|
[MG]A:601 |
1 |
1 |
98 |
◊ |
G |
x,y,z |
1_555 |
5 |
3 |
5045 |
16.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
17.7 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
31 |
56 |
|
[MG]A:601 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
6 |
3 |
5036 |
16.5 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.000 |
57 |
|
[MG]C:601 |
1 |
1 |
98 |
◊ |
H |
x,y,z |
1_555 |
7 |
3 |
5043 |
15.5 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
16.0 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.000 |
32 |
58 |
|
[MG]D:701 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
4 |
1 |
5051 |
15.7 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.000 |
59 |
|
[MG]B:701 |
1 |
1 |
98 |
◊ |
G |
x,y,z |
1_555 |
3 |
1 |
5045 |
14.2 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
14.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
60 |
|
[MG]B:701 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
5036 |
14.1 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.000 |
61 |
|
[MG]D:701 |
1 |
1 |
98 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
5043 |
12.8 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
13.4 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
34 |
62 |
|
D |
3 |
2 |
13980 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
4 |
2 |
13726 |
11.8 |
0.2 |
0.665 |
0 |
0 |
0 |
0.000 |
35 |
63 |
|
[MG]C:601 |
1 |
1 |
98 |
◊ |
G |
x,y,z |
1_555 |
2 |
2 |
5045 |
11.7 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
64 |
|
[MG]A:601 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
2 |
2 |
5051 |
9.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
10.7 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
65 |
|
[MG]C:601 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
2 |
2 |
5036 |
10.2 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
66 |
|
[MG]A:601 |
1 |
1 |
98 |
◊ |
H |
x,y,z |
1_555 |
2 |
2 |
5043 |
10.1 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
10.2 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
|