| ## |
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 |
|
E |
230 |
56 |
14429 |
◊ |
D |
x,y,z |
1_555 |
238 |
62 |
14923 |
2367.8 |
-36.3 |
0.013 |
14 |
13 |
0 |
0.582 |
2 |
|
B |
226 |
54 |
14765 |
◊ |
A |
x,y,z |
1_555 |
228 |
58 |
14859 |
2295.4 |
-36.9 |
0.008 |
15 |
15 |
0 |
0.582 |
| Average: |
2331.6 |
-36.6 |
0.010 |
15 |
14 |
0 |
0.582 |
| 2 |
3 |
|
F |
76 |
20 |
7232 |
◊ |
E |
x,y,z |
1_555 |
66 |
19 |
14429 |
697.6 |
-8.9 |
0.153 |
8 |
5 |
0 |
0.119 |
| 3 |
4 |
|
C |
77 |
19 |
6907 |
◊ |
B |
x,y,z |
1_555 |
67 |
20 |
14765 |
692.1 |
-9.7 |
0.128 |
9 |
8 |
0 |
0.125 |
| 4 |
5 |
|
D |
54 |
12 |
14923 |
◊ |
A |
x-1,y,z |
1_455 |
58 |
15 |
14859 |
597.8 |
-7.2 |
0.221 |
6 |
5 |
0 |
0.000 |
6 |
|
A |
49 |
12 |
14859 |
◊ |
D |
x,y,z-1 |
1_554 |
61 |
16 |
14923 |
568.7 |
-8.9 |
0.125 |
2 |
0 |
0 |
0.000 |
| Average: |
583.2 |
-8.0 |
0.173 |
4 |
3 |
0 |
0.000 |
| 5 |
7 |
|
D |
63 |
19 |
14923 |
◊ |
B |
x-1,y,z |
1_455 |
62 |
16 |
14765 |
586.7 |
-8.8 |
0.161 |
1 |
0 |
0 |
0.000 |
8 |
|
A |
62 |
17 |
14859 |
◊ |
E |
x,y,z-1 |
1_554 |
59 |
14 |
14429 |
554.1 |
-10.2 |
0.110 |
1 |
0 |
0 |
0.000 |
| Average: |
570.4 |
-9.5 |
0.135 |
1 |
0 |
0 |
0.000 |
| 6 |
9 |
|
F |
53 |
13 |
7232 |
◊ |
C |
x,y,z |
1_555 |
60 |
14 |
6907 |
519.5 |
-7.3 |
0.166 |
1 |
2 |
0 |
0.000 |
| 7 |
10 |
|
E |
44 |
13 |
14429 |
◊ |
B |
x-1,y,z |
1_455 |
48 |
10 |
14765 |
438.2 |
-2.7 |
0.493 |
3 |
0 |
0 |
0.000 |
11 |
|
B |
46 |
12 |
14765 |
◊ |
E |
x,y,z-1 |
1_554 |
50 |
12 |
14429 |
436.0 |
-1.8 |
0.564 |
3 |
2 |
0 |
0.000 |
| Average: |
437.1 |
-2.3 |
0.528 |
3 |
1 |
0 |
0.000 |
| 8 |
12 |
|
F |
46 |
15 |
7232 |
◊ |
D |
x,y,z |
1_555 |
40 |
13 |
14923 |
412.9 |
-1.5 |
0.410 |
5 |
4 |
0 |
0.024 |
13 |
|
C |
36 |
11 |
6907 |
◊ |
A |
x,y,z |
1_555 |
32 |
10 |
14859 |
316.4 |
-1.2 |
0.390 |
3 |
3 |
0 |
0.024 |
| Average: |
364.6 |
-1.4 |
0.400 |
4 |
4 |
0 |
0.024 |
| 9 |
14 |
|
[ACP]D:401 |
31 |
1 |
603 |
f |
D |
x,y,z |
1_555 |
57 |
20 |
14923 |
388.5 |
-1.3 |
0.602 |
10 |
0 |
0 |
0.080 |
15 |
|
[ACP]A:401 |
31 |
1 |
600 |
f |
A |
x,y,z |
1_555 |
55 |
18 |
14859 |
377.8 |
-1.9 |
0.567 |
10 |
0 |
0 |
0.080 |
| Average: |
383.1 |
-1.6 |
0.585 |
10 |
0 |
0 |
0.080 |
| 10 |
16 |
|
[ACP]B:401 |
31 |
1 |
606 |
f |
B |
x,y,z |
1_555 |
54 |
20 |
14765 |
385.4 |
-1.9 |
0.551 |
10 |
0 |
0 |
0.080 |
17 |
|
[ACP]E:401 |
31 |
1 |
601 |
f |
E |
x,y,z |
1_555 |
60 |
22 |
14429 |
381.3 |
-1.4 |
0.595 |
10 |
0 |
0 |
0.080 |
| Average: |
383.3 |
-1.6 |
0.573 |
10 |
0 |
0 |
0.080 |
| 11 |
18 |
|
E |
46 |
13 |
14429 |
◊ |
A |
x-1,y,z |
1_455 |
40 |
9 |
14859 |
341.3 |
-0.1 |
0.677 |
3 |
1 |
0 |
0.000 |
19 |
|
B |
40 |
11 |
14765 |
◊ |
D |
x,y,z-1 |
1_554 |
40 |
9 |
14923 |
312.6 |
-3.0 |
0.427 |
2 |
0 |
0 |
0.000 |
| Average: |
327.0 |
-1.5 |
0.552 |
3 |
1 |
0 |
0.000 |
| 12 |
20 |
|
E |
30 |
11 |
14429 |
◊ |
B |
-x-1,y-1/2,-z |
2_445 |
29 |
11 |
14765 |
304.3 |
-2.8 |
0.396 |
4 |
4 |
0 |
0.000 |
| 13 |
21 |
|
E |
15 |
6 |
14429 |
x |
E |
-x-1,y-1/2,-z+1 |
2_446 |
18 |
4 |
14429 |
136.7 |
0.0 |
0.643 |
4 |
0 |
0 |
0.000 |
22 |
|
B |
16 |
4 |
14765 |
x |
B |
-x,y-1/2,-z |
2_545 |
13 |
6 |
14765 |
123.8 |
0.1 |
0.541 |
0 |
0 |
0 |
0.000 |
| Average: |
130.2 |
0.1 |
0.592 |
2 |
0 |
0 |
0.000 |
| 14 |
23 |
|
C |
14 |
6 |
6907 |
◊ |
F |
-x-1,y-1/2,-z |
2_445 |
15 |
6 |
7232 |
136.0 |
3.2 |
0.925 |
2 |
2 |
0 |
0.000 |
| 15 |
24 |
|
D |
12 |
5 |
14923 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
14859 |
128.7 |
1.0 |
0.764 |
2 |
3 |
0 |
0.000 |
| 16 |
25 |
|
[K]F:201 |
1 |
1 |
216 |
f |
F |
x,y,z |
1_555 |
17 |
7 |
7232 |
110.9 |
-81.2 |
0.000 |
0 |
0 |
0 |
0.736 |
26 |
|
[K]C:202 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
18 |
7 |
6907 |
109.8 |
-78.6 |
0.000 |
0 |
0 |
0 |
0.736 |
| Average: |
110.4 |
-79.9 |
0.000 |
0 |
0 |
0 |
0.736 |
| 17 |
27 |
|
C |
11 |
5 |
6907 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
5 |
1 |
14765 |
60.1 |
0.5 |
0.710 |
0 |
0 |
0 |
0.000 |
| 18 |
28 |
|
[MG]C:201 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
6 |
6907 |
51.8 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.067 |
| 19 |
29 |
|
E |
6 |
2 |
14429 |
◊ |
C |
x-1,y,z |
1_455 |
5 |
2 |
6907 |
42.8 |
-0.9 |
0.345 |
0 |
0 |
0 |
0.000 |
30 |
|
B |
6 |
1 |
14765 |
◊ |
F |
x,y,z-1 |
1_554 |
2 |
1 |
7232 |
36.8 |
-1.5 |
0.057 |
0 |
0 |
0 |
0.000 |
| Average: |
39.8 |
-1.2 |
0.201 |
0 |
0 |
0 |
0.000 |
| 20 |
31 |
|
[MG]D:402 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
14923 |
39.4 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.065 |
32 |
|
[MG]A:402 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
14859 |
39.3 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.065 |
| Average: |
39.3 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.065 |
| 21 |
33 |
|
[MG]B:402 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
14765 |
39.1 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.064 |
34 |
|
[MG]E:402 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
11 |
5 |
14429 |
38.4 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.064 |
| Average: |
38.8 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.064 |
| 22 |
35 |
|
A |
3 |
2 |
14859 |
◊ |
[ACP]E:401 |
x,y,z-1 |
1_554 |
4 |
1 |
601 |
37.5 |
1.0 |
0.739 |
0 |
0 |
0 |
0.000 |
36 |
|
D |
3 |
2 |
14923 |
◊ |
[ACP]B:401 |
x-1,y,z |
1_455 |
4 |
1 |
606 |
37.4 |
1.2 |
0.759 |
1 |
0 |
0 |
0.000 |
| Average: |
37.5 |
1.1 |
0.749 |
1 |
0 |
0 |
0.000 |
| 23 |
37 |
|
[MG]E:402 |
1 |
1 |
98 |
f |
[ACP]E:401 |
x,y,z |
1_555 |
4 |
1 |
601 |
34.2 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.137 |
38 |
|
[MG]A:402 |
1 |
1 |
98 |
f |
[ACP]A:401 |
x,y,z |
1_555 |
4 |
1 |
600 |
34.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.137 |
39 |
|
[MG]D:402 |
1 |
1 |
98 |
f |
[ACP]D:401 |
x,y,z |
1_555 |
4 |
1 |
603 |
34.1 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.137 |
40 |
|
[MG]B:402 |
1 |
1 |
98 |
f |
[ACP]B:401 |
x,y,z |
1_555 |
4 |
1 |
606 |
33.5 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.137 |
| Average: |
34.0 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.137 |
| 24 |
41 |
|
[MG]C:201 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
14765 |
7.7 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.006 |
| 25 |
42 |
|
A |
1 |
1 |
14859 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
14765 |
1.1 |
-0.0 |
0.568 |
0 |
0 |
0 |
0.000 |
| 26 |
43 |
|
C |
1 |
1 |
6907 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
14923 |
0.8 |
0.0 |
0.741 |
0 |
0 |
0 |
0.000 |
|