## |
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 |
103 |
11 |
4505 |
◊ |
A |
x,y,z |
1_555 |
106 |
39 |
17892 |
974.4 |
-9.5 |
0.395 |
22 |
0 |
0 |
0.361 |
2 |
2 |
|
A |
84 |
27 |
17892 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
92 |
29 |
19063 |
838.1 |
-2.0 |
0.463 |
5 |
1 |
0 |
0.000 |
3 |
3 |
|
J |
63 |
7 |
2422 |
◊ |
B |
x,y,z |
1_555 |
82 |
29 |
19063 |
685.1 |
-11.7 |
0.243 |
14 |
0 |
0 |
0.336 |
4 |
4 |
|
E |
58 |
13 |
4505 |
◊ |
D |
x,y,z |
1_555 |
52 |
12 |
2855 |
542.9 |
-6.8 |
0.539 |
34 |
0 |
0 |
1.000 |
5 |
5 |
|
D |
58 |
8 |
2855 |
◊ |
A |
x,y,z |
1_555 |
62 |
22 |
17892 |
532.4 |
-14.6 |
0.214 |
15 |
0 |
0 |
0.379 |
6 |
6 |
|
H |
56 |
7 |
2281 |
◊ |
B |
x,y,z |
1_555 |
54 |
21 |
19063 |
449.9 |
-8.1 |
0.389 |
10 |
0 |
0 |
0.264 |
7 |
7 |
|
J |
38 |
8 |
2422 |
◊ |
H |
x,y,z |
1_555 |
37 |
9 |
2281 |
379.6 |
-1.5 |
0.640 |
20 |
0 |
0 |
1.000 |
8 |
8 |
|
A |
30 |
9 |
17892 |
x |
A |
x-1,y,z |
1_455 |
33 |
9 |
17892 |
312.4 |
-6.2 |
0.063 |
3 |
0 |
0 |
0.000 |
9 |
|
B |
30 |
9 |
19063 |
x |
B |
x-1,y,z |
1_455 |
32 |
11 |
19063 |
307.8 |
-4.9 |
0.128 |
2 |
0 |
0 |
0.000 |
Average: |
310.1 |
-5.5 |
0.096 |
3 |
0 |
0 |
0.000 |
9 |
10 |
|
A |
37 |
13 |
17892 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
32 |
10 |
19063 |
311.3 |
-0.4 |
0.535 |
3 |
1 |
0 |
0.000 |
10 |
11 |
|
[DGT]B:1414 |
27 |
1 |
584 |
f |
B |
x,y,z |
1_555 |
45 |
20 |
19063 |
292.4 |
0.1 |
0.522 |
5 |
0 |
0 |
0.057 |
12 |
|
[DGT]A:414 |
29 |
1 |
584 |
f |
A |
x,y,z |
1_555 |
45 |
19 |
17892 |
290.3 |
0.1 |
0.539 |
7 |
0 |
0 |
0.057 |
Average: |
291.3 |
0.1 |
0.531 |
6 |
0 |
0 |
0.057 |
11 |
13 |
|
A |
31 |
10 |
17892 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
23 |
6 |
17892 |
236.0 |
1.5 |
0.664 |
1 |
1 |
0 |
0.000 |
12 |
14 |
|
[ME6]E:906 |
20 |
1 |
465 |
cf |
E |
x,y,z |
1_555 |
26 |
2 |
4505 |
208.9 |
4.4 |
0.752 |
0 |
0 |
0 |
0.000 |
13 |
15 |
|
[ME6]J:1906 |
19 |
1 |
457 |
cf |
J |
x,y,z |
1_555 |
24 |
2 |
2422 |
206.1 |
4.0 |
0.752 |
0 |
0 |
0 |
0.000 |
14 |
16 |
|
E |
20 |
3 |
4505 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
27 |
7 |
17892 |
180.2 |
-2.6 |
0.396 |
3 |
0 |
0 |
0.000 |
15 |
17 |
|
[ME6]J:1906 |
14 |
1 |
457 |
◊ |
B |
x,y,z |
1_555 |
27 |
9 |
19063 |
175.6 |
-0.8 |
0.438 |
6 |
0 |
0 |
0.064 |
18 |
|
[ME6]E:906 |
13 |
1 |
465 |
◊ |
A |
x,y,z |
1_555 |
25 |
10 |
17892 |
164.1 |
0.2 |
0.514 |
6 |
0 |
0 |
0.064 |
Average: |
169.9 |
-0.3 |
0.476 |
6 |
0 |
0 |
0.064 |
16 |
19 |
|
E |
20 |
4 |
4505 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
22 |
6 |
19063 |
171.7 |
1.0 |
0.660 |
3 |
0 |
0 |
0.000 |
17 |
20 |
|
A |
18 |
6 |
17892 |
x |
A |
-x,y-1/2,-z |
2_545 |
14 |
3 |
17892 |
157.1 |
-0.4 |
0.371 |
1 |
1 |
0 |
0.000 |
18 |
21 |
|
D |
17 |
2 |
2855 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
17 |
4 |
19063 |
124.8 |
3.4 |
0.870 |
0 |
0 |
0 |
0.000 |
19 |
22 |
|
[2DT]H:1814 |
16 |
1 |
429 |
cf |
H |
x,y,z |
1_555 |
15 |
1 |
2281 |
113.4 |
2.4 |
0.618 |
0 |
0 |
0 |
0.000 |
20 |
23 |
|
[2DT]D:814 |
15 |
1 |
423 |
cf |
D |
x,y,z |
1_555 |
15 |
1 |
2855 |
112.7 |
2.6 |
0.591 |
0 |
0 |
0 |
0.000 |
21 |
24 |
|
[2DT]H:1814 |
15 |
1 |
429 |
◊ |
[DGT]B:1414 |
x,y,z |
1_555 |
18 |
1 |
584 |
108.7 |
2.1 |
0.530 |
0 |
0 |
0 |
0.000 |
22 |
25 |
|
[2DT]D:814 |
13 |
1 |
423 |
◊ |
[DGT]A:414 |
x,y,z |
1_555 |
13 |
1 |
584 |
86.5 |
1.9 |
0.492 |
1 |
0 |
0 |
0.000 |
23 |
26 |
|
[2DT]D:814 |
6 |
1 |
423 |
◊ |
A |
x,y,z |
1_555 |
16 |
8 |
17892 |
84.4 |
0.9 |
0.558 |
1 |
0 |
0 |
0.000 |
24 |
27 |
|
[2DT]H:1814 |
9 |
1 |
429 |
◊ |
B |
x,y,z |
1_555 |
13 |
9 |
19063 |
80.2 |
-0.0 |
0.485 |
1 |
0 |
0 |
0.010 |
25 |
28 |
|
[DGT]A:414 |
5 |
1 |
584 |
◊ |
E |
x,y,z |
1_555 |
5 |
1 |
4505 |
51.2 |
-0.3 |
0.439 |
3 |
0 |
0 |
0.030 |
26 |
29 |
|
[DGT]B:1414 |
4 |
1 |
584 |
◊ |
J |
x,y,z |
1_555 |
4 |
1 |
2422 |
49.1 |
-0.0 |
0.485 |
3 |
0 |
0 |
0.025 |
27 |
30 |
|
[ME6]E:906 |
11 |
1 |
465 |
◊ |
[DGT]A:414 |
x,y,z |
1_555 |
8 |
1 |
584 |
47.1 |
0.9 |
0.556 |
0 |
0 |
0 |
0.000 |
28 |
31 |
|
[CA]A:417 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
17892 |
40.3 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.158 |
32 |
|
[CA]B:1417 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
5 |
19063 |
36.8 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.158 |
Average: |
38.5 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.158 |
29 |
33 |
|
[ME6]J:1906 |
7 |
1 |
457 |
◊ |
[DGT]B:1414 |
x,y,z |
1_555 |
5 |
1 |
584 |
36.1 |
0.7 |
0.555 |
1 |
0 |
0 |
0.000 |
30 |
34 |
|
[2DT]H:1814 |
6 |
1 |
429 |
◊ |
J |
x,y,z |
1_555 |
6 |
2 |
2422 |
35.6 |
0.5 |
0.518 |
0 |
0 |
0 |
0.000 |
31 |
35 |
|
[ME6]J:1906 |
3 |
1 |
457 |
◊ |
H |
x,y,z |
1_555 |
6 |
1 |
2281 |
32.9 |
-0.7 |
0.432 |
0 |
0 |
0 |
0.165 |
32 |
36 |
|
[ME6]J:1906 |
2 |
1 |
457 |
◊ |
[2DT]H:1814 |
x,y,z |
1_555 |
3 |
1 |
429 |
31.5 |
0.1 |
0.406 |
0 |
0 |
0 |
0.000 |
33 |
37 |
|
[ME6]E:906 |
3 |
1 |
465 |
◊ |
[2DT]D:814 |
x,y,z |
1_555 |
4 |
1 |
423 |
30.0 |
-0.1 |
0.392 |
0 |
0 |
0 |
0.007 |
34 |
38 |
|
[CA]B:1415 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
19063 |
27.9 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.133 |
39 |
|
[CA]A:415 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
17892 |
25.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.133 |
Average: |
26.7 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.133 |
35 |
40 |
|
[CA]B:1416 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
19063 |
27.8 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.123 |
41 |
|
[CA]A:416 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
17892 |
27.4 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.123 |
Average: |
27.6 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.123 |
36 |
42 |
|
[CA]B:1416 |
1 |
1 |
85 |
f |
[DGT]B:1414 |
x,y,z |
1_555 |
4 |
1 |
584 |
27.6 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.129 |
43 |
|
[CA]A:416 |
1 |
1 |
85 |
f |
[DGT]A:414 |
x,y,z |
1_555 |
5 |
1 |
584 |
26.3 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.129 |
Average: |
26.9 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.129 |
37 |
44 |
|
[ME6]E:906 |
2 |
1 |
465 |
◊ |
D |
x,y,z |
1_555 |
5 |
1 |
2855 |
22.5 |
-0.7 |
0.402 |
0 |
0 |
0 |
0.047 |
38 |
45 |
|
[CA]B:1415 |
1 |
1 |
85 |
f |
[DGT]B:1414 |
x,y,z |
1_555 |
4 |
1 |
584 |
21.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.084 |
46 |
|
[CA]A:415 |
1 |
1 |
85 |
f |
[DGT]A:414 |
x,y,z |
1_555 |
4 |
1 |
584 |
21.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.084 |
Average: |
21.1 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.084 |
39 |
47 |
|
[2DT]D:814 |
5 |
1 |
423 |
◊ |
E |
x,y,z |
1_555 |
5 |
2 |
4505 |
20.2 |
0.3 |
0.469 |
0 |
0 |
0 |
0.000 |
40 |
48 |
|
[2DT]D:814 |
3 |
1 |
423 |
◊ |
[CA]A:415 |
x,y,z |
1_555 |
1 |
1 |
85 |
18.2 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.033 |
41 |
49 |
|
[2DT]H:1814 |
4 |
1 |
429 |
◊ |
[CA]B:1415 |
x,y,z |
1_555 |
1 |
1 |
85 |
14.2 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.039 |
42 |
50 |
|
[CA]A:417 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
2855 |
11.0 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.039 |
43 |
51 |
|
[CA]B:1417 |
1 |
1 |
85 |
◊ |
H |
x,y,z |
1_555 |
2 |
1 |
2281 |
10.9 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.046 |
44 |
52 |
|
[CA]B:1416 |
1 |
1 |
85 |
f |
[CA]B:1415 |
x,y,z |
1_555 |
1 |
1 |
85 |
10.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.064 |
45 |
53 |
|
[CA]A:416 |
1 |
1 |
85 |
f |
[CA]A:415 |
x,y,z |
1_555 |
1 |
1 |
85 |
9.0 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.050 |
46 |
54 |
|
B |
2 |
2 |
19063 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
17892 |
8.0 |
0.3 |
0.729 |
0 |
0 |
0 |
0.000 |
47 |
55 |
|
A |
4 |
2 |
17892 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
4505 |
3.4 |
-0.2 |
0.339 |
0 |
0 |
0 |
0.000 |
48 |
56 |
|
H |
1 |
1 |
2281 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
19063 |
2.2 |
-0.1 |
0.414 |
0 |
0 |
0 |
0.000 |
49 |
57 |
|
B |
1 |
1 |
19063 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
19063 |
0.3 |
-0.0 |
0.653 |
0 |
0 |
0 |
0.000 |
|