## |
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 |
257 |
59 |
12620 |
◊ |
A |
x,y,z |
1_555 |
263 |
59 |
12552 |
2494.6 |
-28.6 |
0.045 |
44 |
6 |
0 |
1.000 |
2 |
|
C |
256 |
60 |
12858 |
◊ |
C |
x-y,-y,-z+1/3 |
5_555 |
256 |
60 |
12858 |
2445.0 |
-27.6 |
0.073 |
51 |
6 |
0 |
1.000 |
Average: |
2469.8 |
-28.1 |
0.059 |
48 |
6 |
0 |
1.000 |
2 |
3 |
|
C |
47 |
12 |
12858 |
◊ |
C |
-x,-x+y,-z-1/3 |
6_554 |
46 |
12 |
12858 |
445.1 |
-1.0 |
0.636 |
2 |
0 |
0 |
0.000 |
4 |
|
A |
44 |
11 |
12552 |
◊ |
B |
-y+1,x-y+1,z+2/3 |
2_665 |
44 |
12 |
12620 |
404.8 |
-2.3 |
0.486 |
3 |
0 |
0 |
0.000 |
Average: |
424.9 |
-1.6 |
0.561 |
3 |
0 |
0 |
0.000 |
3 |
5 |
|
D |
31 |
4 |
724 |
◊ |
A |
x,y,z |
1_555 |
53 |
22 |
12552 |
432.3 |
3.6 |
0.635 |
15 |
10 |
0 |
1.000 |
6 |
|
F |
31 |
4 |
727 |
◊ |
C |
x,y,z |
1_555 |
52 |
21 |
12858 |
423.1 |
2.3 |
0.640 |
14 |
10 |
0 |
1.000 |
7 |
|
E |
31 |
4 |
719 |
◊ |
B |
x,y,z |
1_555 |
50 |
21 |
12620 |
416.1 |
2.3 |
0.603 |
13 |
9 |
0 |
1.000 |
Average: |
423.8 |
2.7 |
0.626 |
14 |
10 |
0 |
1.000 |
4 |
8 |
|
C |
33 |
10 |
12858 |
◊ |
B |
-y+1,x-y,z-1/3 |
2_654 |
39 |
11 |
12620 |
322.8 |
-1.1 |
0.546 |
7 |
0 |
0 |
0.000 |
5 |
9 |
|
B |
31 |
9 |
12620 |
x |
B |
-y+1,x-y+1,z-1/3 |
2_664 |
33 |
10 |
12620 |
308.9 |
-1.9 |
0.407 |
1 |
0 |
0 |
0.000 |
10 |
|
A |
36 |
10 |
12552 |
x |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
29 |
9 |
12552 |
302.4 |
-2.3 |
0.341 |
1 |
0 |
0 |
0.000 |
11 |
|
C |
29 |
8 |
12858 |
x |
C |
-y,x-y,z-1/3 |
2_554 |
37 |
10 |
12858 |
279.1 |
-2.1 |
0.459 |
1 |
0 |
0 |
0.000 |
Average: |
296.8 |
-2.1 |
0.402 |
1 |
0 |
0 |
0.000 |
6 |
12 |
|
C |
26 |
7 |
12858 |
◊ |
A |
-y+1,x-y,z-1/3 |
2_654 |
30 |
8 |
12552 |
256.8 |
-1.8 |
0.449 |
3 |
3 |
0 |
0.000 |
7 |
13 |
|
C |
21 |
7 |
12858 |
◊ |
C |
y,x,-z |
4_555 |
21 |
7 |
12858 |
214.9 |
2.6 |
0.876 |
4 |
2 |
0 |
0.000 |
14 |
|
B |
19 |
6 |
12620 |
◊ |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
17 |
5 |
12552 |
189.2 |
2.9 |
0.894 |
6 |
2 |
0 |
0.000 |
Average: |
202.0 |
2.7 |
0.885 |
5 |
2 |
0 |
0.000 |
8 |
15 |
|
B |
10 |
4 |
12620 |
◊ |
B |
y,x,-z+1 |
4_556 |
10 |
4 |
12620 |
121.3 |
3.1 |
0.935 |
2 |
4 |
0 |
0.000 |
9 |
16 |
|
[EDO]C:501 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
14 |
10 |
12858 |
102.5 |
4.1 |
0.696 |
3 |
0 |
0 |
0.000 |
10 |
17 |
|
[EDO]B:503 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
14 |
9 |
12620 |
98.1 |
4.2 |
0.685 |
3 |
0 |
0 |
0.000 |
11 |
18 |
|
[EDO]A:506 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
21 |
8 |
12552 |
94.3 |
3.1 |
0.660 |
4 |
0 |
0 |
0.000 |
12 |
19 |
|
[EDO]C:504 |
4 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
22 |
8 |
12858 |
92.0 |
3.0 |
0.677 |
3 |
0 |
0 |
0.000 |
20 |
|
[EDO]B:507 |
4 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
23 |
8 |
12620 |
91.1 |
3.0 |
0.673 |
3 |
0 |
0 |
0.000 |
Average: |
91.5 |
3.0 |
0.675 |
3 |
0 |
0 |
0.000 |
13 |
21 |
|
[EDO]C:502 |
4 |
1 |
184 |
◊ |
C |
x,y,z |
1_555 |
14 |
7 |
12858 |
87.2 |
3.2 |
0.655 |
5 |
0 |
0 |
0.000 |
14 |
22 |
|
[EDO]B:505 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
15 |
6 |
12620 |
86.8 |
1.5 |
0.214 |
0 |
0 |
0 |
0.000 |
15 |
23 |
|
[ACE]F:500 |
3 |
1 |
165 |
◊ |
C |
x,y,z |
1_555 |
8 |
5 |
12858 |
71.5 |
-0.1 |
0.788 |
2 |
0 |
0 |
0.240 |
16 |
24 |
|
[ACE]E:500 |
3 |
1 |
166 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
12620 |
68.1 |
-0.1 |
0.779 |
2 |
0 |
0 |
0.000 |
17 |
25 |
|
[ACE]D:500 |
3 |
1 |
166 |
◊ |
A |
x,y,z |
1_555 |
8 |
5 |
12552 |
66.2 |
0.0 |
0.782 |
2 |
0 |
0 |
0.000 |
18 |
26 |
|
[ACE]E:500 |
3 |
1 |
166 |
cf |
E |
x,y,z |
1_555 |
7 |
2 |
719 |
59.8 |
-0.3 |
0.698 |
1 |
0 |
0 |
0.000 |
19 |
27 |
|
[ACE]F:500 |
3 |
1 |
165 |
cf |
F |
x,y,z |
1_555 |
8 |
2 |
727 |
59.6 |
-0.2 |
0.716 |
1 |
0 |
0 |
0.162 |
20 |
28 |
|
[ACE]D:500 |
3 |
1 |
166 |
cf |
D |
x,y,z |
1_555 |
7 |
2 |
724 |
59.3 |
-0.3 |
0.710 |
1 |
0 |
0 |
0.000 |
21 |
29 |
|
[EDO]C:508 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
10 |
4 |
12858 |
59.2 |
1.1 |
0.829 |
4 |
0 |
0 |
0.166 |
22 |
30 |
|
[EDO]C:508 |
4 |
1 |
184 |
◊ |
C |
x-y,-y,-z+1/3 |
5_555 |
6 |
3 |
12858 |
53.4 |
1.1 |
0.631 |
0 |
0 |
0 |
0.000 |
23 |
31 |
|
[0QE]E:505 |
1 |
1 |
129 |
c |
B |
x,y,z |
1_555 |
11 |
5 |
12620 |
53.0 |
2.2 |
0.646 |
0 |
0 |
0 |
0.000 |
32 |
|
[0QE]F:505 |
1 |
1 |
129 |
c |
C |
x,y,z |
1_555 |
13 |
6 |
12858 |
52.9 |
2.1 |
0.673 |
0 |
0 |
0 |
0.000 |
33 |
|
[0QE]D:505 |
1 |
1 |
129 |
c |
A |
x,y,z |
1_555 |
13 |
6 |
12552 |
52.6 |
2.2 |
0.659 |
0 |
0 |
0 |
0.000 |
Average: |
52.8 |
2.2 |
0.660 |
0 |
0 |
0 |
0.000 |
24 |
34 |
|
[0QE]F:505 |
1 |
1 |
129 |
cf |
F |
x,y,z |
1_555 |
7 |
2 |
727 |
47.2 |
1.4 |
0.562 |
0 |
0 |
0 |
0.000 |
35 |
|
[0QE]E:505 |
1 |
1 |
129 |
cf |
E |
x,y,z |
1_555 |
6 |
2 |
719 |
46.9 |
1.5 |
0.544 |
0 |
0 |
0 |
0.000 |
36 |
|
[0QE]D:505 |
1 |
1 |
129 |
cf |
D |
x,y,z |
1_555 |
6 |
2 |
724 |
46.6 |
1.4 |
0.553 |
0 |
0 |
0 |
0.000 |
Average: |
46.9 |
1.4 |
0.553 |
0 |
0 |
0 |
0.000 |
25 |
37 |
|
[EDO]B:507 |
2 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
12552 |
43.8 |
0.4 |
0.359 |
0 |
0 |
0 |
0.000 |
38 |
|
[EDO]C:504 |
2 |
1 |
183 |
f |
C |
x-y,-y,-z+1/3 |
5_555 |
6 |
3 |
12858 |
42.6 |
0.3 |
0.348 |
0 |
0 |
0 |
0.000 |
Average: |
43.2 |
0.3 |
0.354 |
0 |
0 |
0 |
0.000 |
26 |
39 |
|
A |
4 |
1 |
12552 |
◊ |
E |
-y+1,x-y+1,z+2/3 |
2_665 |
5 |
1 |
719 |
41.0 |
-0.1 |
0.501 |
1 |
2 |
0 |
0.000 |
40 |
|
D |
5 |
1 |
724 |
◊ |
B |
-y+1,x-y+1,z+2/3 |
2_665 |
6 |
1 |
12620 |
40.5 |
-0.2 |
0.492 |
0 |
2 |
0 |
0.000 |
41 |
|
F |
5 |
1 |
727 |
◊ |
C |
-x,-x+y,-z-1/3 |
6_554 |
6 |
1 |
12858 |
40.0 |
-0.3 |
0.489 |
0 |
2 |
0 |
0.000 |
Average: |
40.5 |
-0.2 |
0.494 |
0 |
2 |
0 |
0.000 |
27 |
42 |
|
[EDO]A:506 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
12620 |
38.1 |
0.1 |
0.488 |
0 |
0 |
0 |
0.000 |
28 |
43 |
|
[EDO]B:505 |
3 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
12552 |
36.7 |
-0.1 |
0.395 |
0 |
0 |
0 |
0.003 |
29 |
44 |
|
[EDO]C:502 |
2 |
1 |
184 |
f |
C |
x-y,-y,-z+1/3 |
5_555 |
5 |
3 |
12858 |
31.6 |
0.7 |
0.505 |
0 |
0 |
0 |
0.000 |
30 |
45 |
|
C |
1 |
1 |
12858 |
◊ |
A |
-x+1,-x+y,-z+2/3 |
6_655 |
1 |
1 |
12552 |
5.6 |
-0.0 |
0.504 |
0 |
0 |
0 |
0.000 |
|