## |
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 |
123 |
40 |
22885 |
◊ |
A |
x,y,z |
1_555 |
121 |
40 |
22923 |
1124.2 |
4.6 |
0.937 |
15 |
14 |
0 |
0.000 |
2 |
2 |
|
A |
129 |
44 |
22923 |
◊ |
Y |
x,y,z |
1_555 |
81 |
14 |
2124 |
1060.3 |
-13.5 |
0.463 |
12 |
1 |
0 |
1.000 |
3 |
|
B |
124 |
43 |
22885 |
◊ |
Z |
x,y,z |
1_555 |
86 |
14 |
2123 |
1056.8 |
-14.2 |
0.454 |
14 |
1 |
0 |
1.000 |
Average: |
1058.5 |
-13.9 |
0.458 |
13 |
1 |
0 |
1.000 |
3 |
4 |
|
A |
53 |
16 |
22923 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
46 |
14 |
22885 |
510.3 |
-4.9 |
0.277 |
3 |
3 |
0 |
0.000 |
5 |
|
A |
46 |
14 |
22923 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
56 |
17 |
22885 |
502.4 |
-4.7 |
0.307 |
4 |
3 |
0 |
0.000 |
Average: |
506.4 |
-4.8 |
0.292 |
4 |
3 |
0 |
0.000 |
4 |
6 |
|
A |
35 |
13 |
22923 |
◊ |
B |
x-1,y,z |
1_455 |
39 |
13 |
22885 |
337.3 |
-0.4 |
0.659 |
6 |
1 |
0 |
0.000 |
5 |
7 |
|
A |
36 |
12 |
22923 |
x |
A |
x,y,z-1 |
1_554 |
34 |
8 |
22923 |
314.1 |
-0.6 |
0.621 |
3 |
3 |
0 |
0.000 |
6 |
8 |
|
B |
21 |
7 |
22885 |
x |
B |
x,y,z-1 |
1_554 |
18 |
7 |
22885 |
149.3 |
-1.4 |
0.465 |
0 |
0 |
0 |
0.000 |
7 |
9 |
|
[EDO]B:1004 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
22885 |
115.9 |
3.5 |
0.626 |
3 |
0 |
0 |
0.000 |
8 |
10 |
|
[EDO]A:1003 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
17 |
8 |
22923 |
110.9 |
3.1 |
0.404 |
1 |
0 |
0 |
0.000 |
9 |
11 |
|
[EDO]A:1010 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
18 |
9 |
22923 |
108.9 |
3.8 |
0.485 |
2 |
0 |
0 |
0.000 |
10 |
12 |
|
[EDO]A:1008 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
22923 |
105.9 |
2.9 |
0.493 |
3 |
0 |
0 |
0.000 |
11 |
13 |
|
[EDO]B:1002 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
21 |
9 |
22885 |
105.0 |
2.8 |
0.470 |
2 |
0 |
0 |
0.000 |
12 |
14 |
|
[EDO]A:1004 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
19 |
9 |
22923 |
102.8 |
2.7 |
0.562 |
2 |
0 |
0 |
0.000 |
13 |
15 |
|
[EDO]A:1009 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
14 |
8 |
22923 |
102.8 |
3.9 |
0.540 |
2 |
0 |
0 |
0.000 |
14 |
16 |
|
[EDO]A:1014 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
22923 |
101.1 |
3.0 |
0.514 |
2 |
0 |
0 |
0.000 |
15 |
17 |
|
[EDO]A:1006 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
22923 |
101.1 |
2.7 |
0.464 |
4 |
0 |
0 |
0.000 |
16 |
18 |
|
[EDO]A:1012 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
22923 |
98.1 |
2.9 |
0.389 |
0 |
0 |
0 |
0.000 |
17 |
19 |
|
[EDO]B:1005 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
15 |
5 |
22885 |
97.0 |
3.1 |
0.518 |
2 |
0 |
0 |
0.000 |
18 |
20 |
|
[EDO]B:1003 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
14 |
7 |
22885 |
96.5 |
3.4 |
0.550 |
3 |
0 |
0 |
0.000 |
19 |
21 |
|
[EDO]A:1016 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
22 |
11 |
22923 |
96.3 |
3.5 |
0.659 |
5 |
0 |
0 |
0.000 |
20 |
22 |
|
[EDO]A:1007 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
22923 |
96.1 |
2.3 |
0.374 |
1 |
0 |
0 |
0.000 |
21 |
23 |
|
[GOL]A:1002 |
5 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
22923 |
88.5 |
-0.3 |
0.504 |
0 |
0 |
0 |
0.000 |
22 |
24 |
|
[EDO]A:1011 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
10 |
6 |
22923 |
83.4 |
2.8 |
0.315 |
3 |
0 |
0 |
0.000 |
23 |
25 |
|
[EDO]B:1007 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
14 |
5 |
22885 |
82.8 |
2.8 |
0.319 |
2 |
0 |
0 |
0.000 |
24 |
26 |
|
[EDO]B:1008 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
4 |
22885 |
82.0 |
2.5 |
0.470 |
2 |
0 |
0 |
0.000 |
25 |
27 |
|
[EDO]A:1017 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
22923 |
80.3 |
2.4 |
0.400 |
0 |
0 |
0 |
0.000 |
26 |
28 |
|
[EDO]A:1015 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
12 |
5 |
22923 |
75.3 |
1.5 |
0.206 |
0 |
0 |
0 |
0.000 |
27 |
29 |
|
[EDO]A:1005 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
22923 |
70.8 |
1.7 |
0.754 |
1 |
0 |
0 |
0.000 |
28 |
30 |
|
[EDO]B:1006 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
22885 |
68.0 |
1.9 |
0.267 |
0 |
0 |
0 |
0.000 |
29 |
31 |
|
[EDO]A:1013 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
22923 |
65.9 |
1.5 |
0.689 |
0 |
0 |
0 |
0.000 |
30 |
32 |
|
[EDO]B:1007 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
22923 |
56.4 |
1.2 |
0.232 |
1 |
0 |
0 |
0.000 |
31 |
33 |
|
[EDO]A:1011 |
3 |
1 |
185 |
f |
B |
-x,y-1/2,-z+1 |
2_546 |
6 |
3 |
22885 |
52.4 |
0.9 |
0.591 |
0 |
0 |
0 |
0.000 |
32 |
34 |
|
[EDO]A:1005 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
7 |
1 |
22885 |
51.0 |
1.7 |
0.872 |
0 |
0 |
0 |
0.000 |
33 |
35 |
|
Y |
3 |
2 |
2124 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
6 |
3 |
22885 |
47.4 |
0.3 |
0.767 |
0 |
0 |
0 |
0.000 |
34 |
36 |
|
[EDO]A:1014 |
3 |
1 |
186 |
f |
Y |
x,y,z |
1_555 |
5 |
2 |
2124 |
41.3 |
0.8 |
0.844 |
1 |
0 |
0 |
0.000 |
35 |
37 |
|
A |
3 |
2 |
22923 |
◊ |
[EDO]B:1006 |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
185 |
37.1 |
2.0 |
0.982 |
0 |
0 |
0 |
0.000 |
36 |
38 |
|
A |
7 |
3 |
22923 |
◊ |
Z |
-x+1,y-1/2,-z+1 |
2_646 |
5 |
2 |
2123 |
36.9 |
-0.1 |
0.678 |
0 |
0 |
0 |
0.000 |
37 |
39 |
|
[EDO]B:1007 |
3 |
1 |
184 |
f |
[EDO]A:1005 |
x,y,z |
1_555 |
3 |
1 |
185 |
35.3 |
1.0 |
1.000 |
2 |
0 |
0 |
0.000 |
38 |
40 |
|
[EDO]A:1012 |
4 |
1 |
184 |
f |
B |
x-1,y,z |
1_455 |
2 |
1 |
22885 |
34.0 |
1.3 |
0.979 |
1 |
0 |
0 |
0.000 |
39 |
41 |
|
[EDO]A:1015 |
3 |
1 |
185 |
f |
B |
x-1,y,z |
1_455 |
8 |
3 |
22885 |
32.6 |
0.8 |
0.842 |
1 |
0 |
0 |
0.000 |
40 |
42 |
|
[EDO]A:1004 |
2 |
1 |
185 |
f |
[EDO]A:1003 |
x,y,z |
1_555 |
2 |
1 |
184 |
26.2 |
1.0 |
1.000 |
0 |
0 |
0 |
0.000 |
41 |
43 |
|
A |
3 |
1 |
22923 |
f |
[EDO]B:1003 |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
184 |
23.2 |
0.4 |
0.491 |
0 |
0 |
0 |
0.000 |
42 |
44 |
|
[EDO]A:1016 |
4 |
1 |
183 |
f |
[EDO]A:1004 |
x,y,z |
1_555 |
2 |
1 |
185 |
20.5 |
0.6 |
1.000 |
1 |
0 |
0 |
0.000 |
43 |
45 |
|
[EDO]A:1003 |
2 |
1 |
184 |
f |
Y |
x,y,z |
1_555 |
2 |
1 |
2124 |
14.4 |
0.2 |
0.695 |
0 |
0 |
0 |
0.000 |
44 |
46 |
|
[EDO]A:1009 |
2 |
1 |
183 |
f |
B |
-x+1,y-1/2,-z+1 |
2_646 |
3 |
2 |
22885 |
13.1 |
0.0 |
0.609 |
0 |
0 |
0 |
0.000 |
45 |
47 |
|
[EDO]A:1016 |
2 |
1 |
183 |
f |
[EDO]A:1010 |
x,y,z |
1_555 |
3 |
1 |
185 |
8.4 |
0.5 |
1.000 |
0 |
0 |
0 |
0.000 |
46 |
48 |
|
A |
2 |
1 |
22923 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
22923 |
3.5 |
-0.0 |
0.625 |
0 |
0 |
0 |
0.000 |
|