## |
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 |
117 |
32 |
14853 |
◊ |
A |
x,y,z |
1_555 |
118 |
31 |
14829 |
1209.0 |
-5.1 |
0.509 |
12 |
8 |
0 |
0.000 |
2 |
|
D |
117 |
31 |
14927 |
◊ |
C |
x,y,z |
1_555 |
115 |
31 |
15073 |
1200.9 |
-4.9 |
0.520 |
11 |
8 |
0 |
0.000 |
Average: |
1205.0 |
-5.0 |
0.515 |
12 |
8 |
0 |
0.000 |
2 |
3 |
|
C |
53 |
14 |
15073 |
◊ |
B |
x,y,z |
1_555 |
57 |
16 |
14853 |
516.6 |
2.6 |
0.849 |
7 |
3 |
0 |
0.000 |
4 |
|
B |
53 |
14 |
14853 |
◊ |
C |
x,y,z-1 |
1_554 |
56 |
17 |
15073 |
499.3 |
2.0 |
0.840 |
4 |
3 |
0 |
0.000 |
Average: |
507.9 |
2.3 |
0.845 |
6 |
3 |
0 |
0.000 |
3 |
5 |
|
A |
41 |
12 |
14829 |
◊ |
B |
x,y-1,z |
1_545 |
32 |
13 |
14853 |
366.3 |
-4.1 |
0.253 |
1 |
0 |
0 |
0.000 |
6 |
|
C |
33 |
12 |
15073 |
◊ |
D |
x,y-1,z |
1_545 |
41 |
12 |
14927 |
365.7 |
-4.8 |
0.191 |
1 |
0 |
0 |
0.000 |
Average: |
366.0 |
-4.4 |
0.222 |
1 |
0 |
0 |
0.000 |
4 |
7 |
|
D |
31 |
7 |
14927 |
◊ |
B |
x,y,z |
1_555 |
31 |
10 |
14853 |
274.9 |
-2.3 |
0.405 |
0 |
1 |
0 |
0.000 |
8 |
|
A |
32 |
7 |
14829 |
◊ |
C |
x,y,z-1 |
1_554 |
31 |
10 |
15073 |
271.7 |
-2.1 |
0.430 |
1 |
0 |
0 |
0.000 |
Average: |
273.3 |
-2.2 |
0.417 |
1 |
1 |
0 |
0.000 |
5 |
9 |
|
C |
21 |
7 |
15073 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
14829 |
138.6 |
-1.9 |
0.378 |
0 |
0 |
0 |
0.000 |
10 |
|
B |
17 |
6 |
14853 |
◊ |
D |
x,y,z-1 |
1_554 |
14 |
5 |
14927 |
113.5 |
-1.2 |
0.429 |
0 |
0 |
0 |
0.000 |
Average: |
126.1 |
-1.5 |
0.404 |
0 |
0 |
0 |
0.000 |
6 |
11 |
|
D |
12 |
5 |
14927 |
x |
D |
x-1,y,z |
1_455 |
16 |
6 |
14927 |
127.8 |
-0.3 |
0.526 |
1 |
0 |
0 |
0.000 |
7 |
12 |
|
A |
13 |
5 |
14829 |
◊ |
D |
x,y-1,z-1 |
1_544 |
12 |
5 |
14927 |
115.5 |
-0.5 |
0.537 |
1 |
0 |
0 |
0.000 |
13 |
|
A |
12 |
5 |
14829 |
◊ |
D |
x,y-1,z |
1_545 |
12 |
4 |
14927 |
105.4 |
-0.6 |
0.508 |
1 |
0 |
0 |
0.000 |
Average: |
110.5 |
-0.5 |
0.522 |
1 |
0 |
0 |
0.000 |
8 |
14 |
|
[EDO]B:401 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
14853 |
112.7 |
5.8 |
0.841 |
5 |
0 |
0 |
0.000 |
9 |
15 |
|
[EDO]A:401 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
14829 |
111.6 |
5.7 |
0.594 |
5 |
0 |
0 |
0.000 |
10 |
16 |
|
[EDO]C:401 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
16 |
9 |
15073 |
111.1 |
5.8 |
0.842 |
5 |
0 |
0 |
0.000 |
11 |
17 |
|
[EDO]D:401 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
18 |
8 |
14927 |
110.0 |
5.9 |
0.594 |
4 |
0 |
0 |
0.000 |
12 |
18 |
|
[EDO]A:402 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
14829 |
106.7 |
3.3 |
0.480 |
3 |
0 |
0 |
0.000 |
13 |
19 |
|
[EDO]D:402 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
19 |
8 |
14927 |
106.5 |
3.4 |
0.484 |
4 |
0 |
0 |
0.000 |
14 |
20 |
|
[EDO]B:402 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
14853 |
104.6 |
3.5 |
0.488 |
4 |
0 |
0 |
0.000 |
15 |
21 |
|
C |
10 |
5 |
15073 |
x |
C |
x-1,y,z |
1_455 |
11 |
4 |
15073 |
88.3 |
-0.0 |
0.582 |
0 |
0 |
0 |
0.000 |
16 |
22 |
|
C |
16 |
5 |
15073 |
◊ |
B |
x-1,y,z |
1_455 |
12 |
5 |
14853 |
85.9 |
-0.2 |
0.599 |
0 |
0 |
0 |
0.000 |
17 |
23 |
|
A |
10 |
5 |
14829 |
◊ |
B |
x-1,y-1,z |
1_445 |
5 |
4 |
14853 |
81.3 |
-1.7 |
0.161 |
0 |
0 |
0 |
0.000 |
18 |
24 |
|
[CA]B:404 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
4 |
3 |
14853 |
41.8 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.058 |
25 |
|
[CA]A:403 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
14829 |
41.6 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.058 |
26 |
|
[CA]D:403 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
14927 |
41.4 |
-12.0 |
0.000 |
0 |
0 |
0 |
0.058 |
27 |
|
[CA]C:402 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
5 |
4 |
15073 |
41.3 |
-11.1 |
0.000 |
0 |
0 |
0 |
0.058 |
Average: |
41.5 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.058 |
19 |
28 |
|
[CA]C:403 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
4 |
3 |
15073 |
39.3 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.054 |
29 |
|
[CA]B:403 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
4 |
3 |
14853 |
39.0 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.054 |
30 |
|
[CA]A:404 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
14829 |
38.5 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.054 |
31 |
|
[CA]D:404 |
1 |
1 |
85 |
f |
D |
x,y,z |
1_555 |
4 |
3 |
14927 |
38.5 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.054 |
Average: |
38.8 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.054 |
20 |
32 |
|
C |
7 |
5 |
15073 |
◊ |
D |
x-1,y-1,z |
1_445 |
3 |
2 |
14927 |
36.9 |
-0.6 |
0.275 |
0 |
0 |
0 |
0.000 |
21 |
33 |
|
[CA]B:409 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
7 |
5 |
14853 |
32.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.014 |
22 |
34 |
|
[CA]A:405 |
1 |
1 |
85 |
f |
C |
x,y,z-1 |
1_554 |
4 |
2 |
15073 |
30.5 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.013 |
35 |
|
[CA]B:406 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
14853 |
30.0 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.013 |
Average: |
30.2 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.013 |
23 |
36 |
|
[CA]B:406 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
14927 |
28.3 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.000 |
37 |
|
[CA]A:405 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
14829 |
26.8 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
27.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.000 |
24 |
38 |
|
[CA]B:407 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
14853 |
28.3 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.012 |
39 |
|
[CA]C:405 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
15073 |
27.5 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.012 |
Average: |
27.9 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.012 |
25 |
40 |
|
[CA]C:405 |
1 |
1 |
85 |
◊ |
D |
x,y-1,z |
1_545 |
3 |
1 |
14927 |
27.5 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.000 |
41 |
|
A |
3 |
1 |
14829 |
◊ |
[CA]B:407 |
x,y-1,z |
1_545 |
1 |
1 |
85 |
27.4 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
27.4 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.000 |
26 |
42 |
|
[CA]C:406 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
6 |
4 |
14927 |
26.9 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.000 |
43 |
|
[CA]C:404 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
5 |
4 |
14829 |
26.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.000 |
44 |
|
[CA]B:405 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
14853 |
24.5 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.000 |
45 |
|
[CA]B:408 |
1 |
1 |
85 |
◊ |
C |
x,y,z-1 |
1_554 |
7 |
4 |
15073 |
23.6 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
25.3 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
46 |
|
[CA]C:404 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
3 |
1 |
15073 |
25.7 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.011 |
47 |
|
B |
1 |
1 |
14853 |
f |
[CA]C:406 |
x,y,z-1 |
1_554 |
1 |
1 |
85 |
15.6 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.011 |
Average: |
20.7 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.011 |
28 |
48 |
|
[CA]B:408 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
14853 |
24.6 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.010 |
49 |
|
[CA]B:405 |
1 |
1 |
85 |
f |
C |
x,y,z |
1_555 |
4 |
3 |
15073 |
16.9 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.010 |
Average: |
20.7 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.010 |
29 |
50 |
|
B |
5 |
2 |
14853 |
x |
B |
x-1,y,z |
1_455 |
3 |
1 |
14853 |
23.0 |
0.6 |
0.797 |
1 |
0 |
0 |
0.000 |
30 |
51 |
|
A |
1 |
1 |
14829 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
14829 |
18.1 |
-0.6 |
0.109 |
0 |
0 |
0 |
0.000 |
31 |
52 |
|
[CA]C:404 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
14853 |
16.5 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.000 |
53 |
|
[CA]B:405 |
1 |
1 |
85 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
14829 |
13.5 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
54 |
|
[CA]C:406 |
1 |
1 |
85 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
15073 |
13.4 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
55 |
|
[CA]B:408 |
1 |
1 |
85 |
◊ |
D |
x,y,z-1 |
1_554 |
3 |
1 |
14927 |
12.6 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
14.0 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
32 |
56 |
|
A |
3 |
1 |
14829 |
◊ |
[CA]C:405 |
x,y,z-1 |
1_554 |
1 |
1 |
85 |
11.1 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
57 |
|
[CA]B:407 |
1 |
1 |
85 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
14927 |
9.2 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
10.1 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
58 |
|
[CA]A:404 |
1 |
1 |
85 |
f |
[CA]A:403 |
x,y,z |
1_555 |
1 |
1 |
85 |
10.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.015 |
34 |
59 |
|
[CA]D:404 |
1 |
1 |
85 |
f |
[CA]D:403 |
x,y,z |
1_555 |
1 |
1 |
85 |
10.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.015 |
35 |
60 |
|
[CA]C:403 |
1 |
1 |
85 |
f |
[CA]C:402 |
x,y,z |
1_555 |
1 |
1 |
85 |
9.9 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.008 |
36 |
61 |
|
[CA]B:404 |
1 |
1 |
85 |
f |
[CA]B:403 |
x,y,z |
1_555 |
1 |
1 |
85 |
9.4 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.007 |
37 |
62 |
|
A |
1 |
1 |
14829 |
◊ |
[CA]B:409 |
x-1,y-1,z |
1_445 |
1 |
1 |
85 |
4.7 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
|