## |
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 |
48 |
15 |
11883 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
51 |
13 |
11883 |
504.3 |
-1.3 |
0.388 |
8 |
0 |
0 |
0.000 |
2 |
|
A |
48 |
15 |
11796 |
x |
A |
-x,y-1/2,-z-1/2 |
3_544 |
49 |
13 |
11796 |
498.8 |
0.8 |
0.483 |
7 |
0 |
0 |
0.000 |
Average: |
501.5 |
-0.3 |
0.435 |
8 |
0 |
0 |
0.000 |
2 |
3 |
|
B |
46 |
15 |
11883 |
◊ |
A |
x,y,z |
1_555 |
56 |
20 |
11796 |
433.1 |
-2.9 |
0.351 |
7 |
0 |
1 |
0.111 |
3 |
4 |
|
D |
29 |
5 |
785 |
◊ |
B |
x,y,z |
1_555 |
55 |
18 |
11883 |
334.4 |
0.0 |
0.647 |
10 |
6 |
0 |
0.115 |
4 |
5 |
|
D |
9 |
2 |
785 |
◊ |
A |
x,y,z |
1_555 |
14 |
6 |
11796 |
127.0 |
0.1 |
0.518 |
3 |
0 |
0 |
0.014 |
5 |
6 |
|
[DYW]D:2 |
12 |
1 |
365 |
cf |
D |
x,y,z |
1_555 |
17 |
5 |
785 |
110.5 |
-0.1 |
0.729 |
2 |
0 |
0 |
0.045 |
6 |
7 |
|
[ACT]A:705 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
11796 |
109.2 |
-0.8 |
0.596 |
1 |
0 |
0 |
0.013 |
7 |
8 |
|
[EDO]B:702 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
20 |
10 |
11883 |
107.2 |
3.1 |
0.380 |
0 |
0 |
0 |
0.000 |
8 |
9 |
|
[DYW]D:2 |
10 |
1 |
365 |
◊ |
B |
x,y,z |
1_555 |
16 |
5 |
11883 |
105.7 |
-0.2 |
0.632 |
1 |
0 |
0 |
0.015 |
9 |
10 |
|
[EDO]A:701 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
11796 |
97.6 |
2.9 |
0.293 |
3 |
0 |
0 |
0.000 |
10 |
11 |
|
[ACT]A:703 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
11796 |
89.2 |
-1.0 |
0.407 |
1 |
0 |
0 |
0.016 |
11 |
12 |
|
[EDO]B:701 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
11883 |
87.5 |
2.5 |
0.269 |
3 |
0 |
0 |
0.000 |
12 |
13 |
|
[ACT]A:704 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
11796 |
87.4 |
-0.4 |
0.591 |
4 |
0 |
0 |
0.024 |
13 |
14 |
|
[ACT]A:706 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
11796 |
86.4 |
-0.3 |
0.615 |
2 |
0 |
0 |
0.014 |
14 |
15 |
|
[ACT]B:703 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
11883 |
86.1 |
-0.4 |
0.587 |
3 |
0 |
0 |
0.037 |
15 |
16 |
|
[ACT]A:707 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
4 |
11796 |
83.4 |
-1.4 |
0.524 |
0 |
0 |
0 |
0.015 |
16 |
17 |
|
[DYW]D:2 |
8 |
1 |
365 |
◊ |
A |
x,y,z |
1_555 |
8 |
5 |
11796 |
76.2 |
0.0 |
0.689 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
[EDO]A:702 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
14 |
4 |
11796 |
74.2 |
1.9 |
0.245 |
1 |
0 |
0 |
0.000 |
18 |
19 |
|
[NA]A:710 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
9 |
11796 |
69.7 |
-8.4 |
0.000 |
0 |
0 |
0 |
0.093 |
19 |
20 |
|
[ACT]B:704 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
11883 |
69.3 |
0.2 |
0.657 |
1 |
0 |
0 |
0.006 |
20 |
21 |
|
[NA]B:707 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
11883 |
62.6 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.194 |
21 |
22 |
|
[NA]A:709 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
11796 |
59.6 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.088 |
22 |
23 |
|
[NA]B:706 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
11883 |
59.3 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.170 |
23 |
24 |
|
[NA]B:705 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
11883 |
58.2 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.168 |
24 |
25 |
|
B |
10 |
6 |
11883 |
◊ |
[ACT]B:703 |
x-1/2,-y-1/2,-z |
4_445 |
4 |
1 |
184 |
54.6 |
-1.2 |
0.438 |
0 |
0 |
0 |
0.000 |
25 |
26 |
|
[NA]A:708 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
11796 |
54.5 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.084 |
26 |
27 |
|
[DYW]D:2 |
5 |
1 |
365 |
cf |
[ACE]D:1 |
x,y,z |
1_555 |
3 |
1 |
172 |
54.0 |
-0.7 |
0.734 |
0 |
0 |
0 |
0.032 |
27 |
28 |
|
A |
9 |
6 |
11796 |
◊ |
[ACT]A:704 |
-x,y-1/2,-z-1/2 |
3_544 |
4 |
1 |
183 |
53.4 |
-1.1 |
0.435 |
0 |
0 |
0 |
0.000 |
28 |
29 |
|
[NA]B:708 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
11883 |
52.8 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.132 |
29 |
30 |
|
[EDO]B:701 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
8 |
5 |
11796 |
51.8 |
1.2 |
0.663 |
0 |
0 |
0 |
0.000 |
30 |
31 |
|
[ACE]D:1 |
3 |
1 |
172 |
f |
D |
x,y,z |
1_555 |
11 |
4 |
785 |
49.9 |
0.1 |
0.804 |
3 |
0 |
0 |
0.058 |
31 |
32 |
|
[EDO]A:702 |
4 |
1 |
185 |
f |
A |
-x,y-1/2,-z-1/2 |
3_544 |
6 |
1 |
11796 |
46.1 |
1.1 |
0.728 |
0 |
0 |
0 |
0.000 |
32 |
33 |
|
[ACT]B:704 |
4 |
1 |
186 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
5 |
1 |
11883 |
43.7 |
-0.2 |
0.655 |
0 |
0 |
0 |
0.000 |
33 |
34 |
|
[ACT]A:706 |
4 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
11883 |
39.1 |
0.1 |
0.715 |
0 |
0 |
0 |
0.000 |
34 |
35 |
|
A |
6 |
2 |
11796 |
◊ |
[NA]A:710 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
125 |
37.2 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.000 |
35 |
36 |
|
[NA]B:708 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
785 |
35.9 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.099 |
36 |
37 |
|
[NA]B:705 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
785 |
31.5 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.074 |
37 |
38 |
|
[NA]A:708 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
11883 |
28.5 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.033 |
38 |
39 |
|
[EDO]B:702 |
2 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
785 |
27.4 |
0.7 |
0.427 |
0 |
0 |
0 |
0.000 |
39 |
40 |
|
[ACT]A:705 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
11883 |
23.8 |
0.1 |
0.746 |
0 |
0 |
0 |
0.000 |
40 |
41 |
|
[ACE]D:1 |
3 |
1 |
172 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
11883 |
22.2 |
0.5 |
0.929 |
0 |
0 |
0 |
0.000 |
41 |
42 |
|
[ACT]A:707 |
3 |
1 |
184 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
785 |
20.1 |
-0.2 |
0.515 |
0 |
0 |
0 |
0.002 |
42 |
43 |
|
[NA]A:708 |
1 |
1 |
125 |
f |
[ACT]A:706 |
x,y,z |
1_555 |
3 |
1 |
182 |
17.4 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.021 |
43 |
44 |
|
[ACE]D:1 |
2 |
1 |
172 |
◊ |
[NA]B:708 |
x,y,z |
1_555 |
1 |
1 |
125 |
16.3 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.040 |
44 |
45 |
|
[NA]B:705 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
11796 |
11.8 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.011 |
45 |
46 |
|
[DYW]D:2 |
1 |
1 |
365 |
◊ |
[ACT]A:707 |
x,y,z |
1_555 |
1 |
1 |
184 |
8.5 |
0.2 |
0.598 |
0 |
0 |
0 |
0.000 |
46 |
47 |
|
[ACE]D:1 |
2 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
11796 |
4.5 |
-0.0 |
0.813 |
0 |
0 |
0 |
0.000 |
47 |
48 |
|
[ACT]A:707 |
1 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
11883 |
3.8 |
0.1 |
0.606 |
0 |
0 |
0 |
0.000 |
48 |
49 |
|
[DYW]D:2 |
1 |
1 |
365 |
◊ |
[NA]B:708 |
x,y,z |
1_555 |
1 |
1 |
125 |
3.3 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.007 |
|