## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
401 |
94 |
25860 |
◊ |
A |
x,y,z |
1_555 |
386 |
98 |
9488 |
3807.7 |
-49.5 |
0.013 |
46 |
11 |
0 |
1.000 |
2 |
|
B |
54 |
17 |
25860 |
◊ |
B |
x,-y+1,-z+1 |
4_566 |
54 |
17 |
25860 |
528.9 |
0.3 |
0.714 |
6 |
2 |
0 |
0.000 |
3 |
|
B |
54 |
15 |
25860 |
x |
B |
x-1/2,-y+1/2,-z+1 |
8_456 |
58 |
17 |
25860 |
484.3 |
-2.6 |
0.487 |
6 |
3 |
0 |
0.000 |
4 |
|
A |
43 |
14 |
9488 |
◊ |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
37 |
11 |
25860 |
379.8 |
-0.3 |
0.702 |
5 |
6 |
0 |
0.000 |
5 |
|
[MYR]B:763 |
16 |
1 |
499 |
cf |
B |
x,y,z |
1_555 |
48 |
19 |
25860 |
301.2 |
4.3 |
0.338 |
3 |
0 |
0 |
0.000 |
6 |
|
A |
32 |
10 |
9488 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
8_456 |
32 |
13 |
25860 |
295.0 |
-0.3 |
0.684 |
9 |
4 |
0 |
0.000 |
7 |
|
B |
24 |
10 |
25860 |
x |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
24 |
7 |
25860 |
201.1 |
-1.9 |
0.398 |
0 |
0 |
0 |
0.000 |
8 |
|
B |
15 |
6 |
25860 |
◊ |
A |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
21 |
7 |
9488 |
145.3 |
0.2 |
0.685 |
1 |
1 |
0 |
0.000 |
9 |
|
[EDO]A:4 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
23 |
12 |
9488 |
117.8 |
3.7 |
0.688 |
1 |
0 |
0 |
0.000 |
10 |
|
[EDO]A:10 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
9488 |
109.1 |
2.7 |
0.506 |
4 |
0 |
0 |
0.000 |
11 |
|
[EDO]B:18 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
25860 |
107.5 |
3.5 |
0.496 |
5 |
0 |
0 |
0.000 |
12 |
|
[EDO]B:15 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
21 |
9 |
25860 |
106.7 |
2.6 |
0.414 |
4 |
0 |
0 |
0.000 |
13 |
|
[EDO]B:19 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
23 |
9 |
25860 |
105.7 |
3.1 |
0.448 |
1 |
0 |
0 |
0.000 |
14 |
|
[EDO]B:12 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
17 |
8 |
25860 |
100.7 |
3.1 |
0.419 |
1 |
0 |
0 |
0.000 |
15 |
|
[EDO]B:17 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
25860 |
99.0 |
3.7 |
0.512 |
3 |
0 |
0 |
0.000 |
16 |
|
[EDO]B:13 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
25860 |
96.2 |
3.8 |
0.542 |
0 |
0 |
0 |
0.000 |
17 |
|
A |
13 |
6 |
9488 |
◊ |
[EDO]A:3 |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
4 |
1 |
186 |
91.6 |
2.9 |
0.306 |
3 |
0 |
0 |
0.000 |
18 |
|
[EDO]B:16 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
25860 |
90.7 |
2.6 |
0.289 |
3 |
0 |
0 |
0.000 |
19 |
|
[EDO]B:14 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
25860 |
86.1 |
2.3 |
0.300 |
2 |
0 |
0 |
0.000 |
20 |
|
[EDO]A:8 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
9488 |
85.2 |
2.8 |
0.319 |
2 |
0 |
0 |
0.000 |
21 |
|
A |
13 |
5 |
9488 |
x |
A |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
11 |
5 |
9488 |
83.4 |
-0.1 |
0.670 |
0 |
0 |
0 |
0.000 |
22 |
|
[EDO]A:5 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
9488 |
82.7 |
2.9 |
0.332 |
2 |
0 |
0 |
0.000 |
23 |
|
[EDO]A:11 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
5 |
25860 |
77.6 |
1.1 |
0.198 |
0 |
0 |
0 |
0.000 |
24 |
|
[EDO]A:7 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
9488 |
72.8 |
1.1 |
0.627 |
2 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:2 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
17 |
4 |
9488 |
69.5 |
1.7 |
0.258 |
0 |
0 |
0 |
0.000 |
26 |
|
[MYR]B:763 |
6 |
1 |
499 |
◊ |
A |
x,y,z |
1_555 |
12 |
3 |
9488 |
68.0 |
-2.0 |
0.072 |
0 |
0 |
0 |
0.051 |
27 |
|
[EDO]B:1 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
9488 |
67.3 |
1.9 |
0.283 |
2 |
0 |
0 |
0.000 |
28 |
|
[EDO]B:1 |
3 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
25860 |
63.7 |
1.4 |
0.223 |
0 |
0 |
0 |
0.000 |
29 |
|
[EDO]A:20 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
9488 |
60.6 |
2.1 |
0.932 |
2 |
0 |
0 |
0.000 |
30 |
|
[EDO]A:11 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
9488 |
60.0 |
1.4 |
0.711 |
0 |
0 |
0 |
0.000 |
31 |
|
[EDO]A:3 |
3 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
8 |
2 |
9488 |
55.5 |
1.9 |
0.315 |
1 |
0 |
0 |
0.000 |
32 |
|
[EDO]A:20 |
3 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
4 |
3 |
25860 |
50.4 |
1.1 |
0.127 |
0 |
0 |
0 |
0.000 |
33 |
|
[EDO]A:10 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
25860 |
45.6 |
0.7 |
0.310 |
0 |
0 |
0 |
0.000 |
34 |
|
B |
4 |
1 |
25860 |
◊ |
B |
-x+1,y,-z+3/2 |
3_656 |
4 |
1 |
25860 |
41.0 |
-1.1 |
0.193 |
0 |
0 |
0 |
0.000 |
35 |
|
[EDO]B:21 |
3 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
25860 |
35.7 |
1.2 |
0.834 |
0 |
0 |
0 |
0.000 |
36 |
|
[EDO]A:2 |
3 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
25860 |
34.5 |
0.4 |
0.318 |
0 |
0 |
0 |
0.000 |
37 |
|
A |
3 |
1 |
9488 |
f |
[EDO]A:2 |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
4 |
1 |
184 |
34.0 |
0.1 |
0.459 |
0 |
0 |
0 |
0.000 |
38 |
|
[EDO]B:21 |
3 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
5 |
1 |
9488 |
29.2 |
0.9 |
0.913 |
0 |
0 |
0 |
0.000 |
39 |
|
[EDO]B:12 |
2 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
9488 |
28.2 |
0.3 |
0.598 |
0 |
0 |
0 |
0.000 |
40 |
|
B |
4 |
2 |
25860 |
◊ |
[EDO]A:2 |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
2 |
1 |
184 |
27.9 |
0.1 |
0.522 |
0 |
0 |
0 |
0.000 |
41 |
|
[EDO]A:8 |
2 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
25860 |
26.3 |
0.4 |
0.777 |
0 |
0 |
0 |
0.000 |
42 |
|
[EDO]B:21 |
1 |
1 |
183 |
f |
[EDO]A:8 |
x,y,z |
1_555 |
2 |
1 |
186 |
5.6 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
43 |
|
B |
1 |
1 |
25860 |
f |
[EDO]B:21 |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
1 |
1 |
183 |
4.4 |
0.2 |
0.902 |
0 |
0 |
0 |
0.000 |
44 |
|
[EDO]B:14 |
2 |
1 |
183 |
f |
B |
x,-y+1,-z+1 |
4_566 |
1 |
1 |
25860 |
1.5 |
0.1 |
0.888 |
0 |
0 |
0 |
0.000 |
|