| ## |
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 |
163 |
41 |
13804 |
◊ |
A |
x,y,z |
1_555 |
168 |
41 |
13927 |
1546.1 |
-11.5 |
0.269 |
27 |
12 |
0 |
0.000 |
| 2 |
2 |
|
A |
120 |
33 |
13927 |
◊ |
B |
-y,x-y+1,z |
2_565 |
118 |
35 |
13804 |
1136.4 |
-9.6 |
0.235 |
13 |
0 |
0 |
0.000 |
| 3 |
3 |
|
B |
33 |
9 |
13804 |
◊ |
A |
x-y-1/3,-y+1/3,-z+1/3 |
11_455 |
32 |
10 |
13927 |
294.8 |
0.4 |
0.631 |
4 |
3 |
0 |
0.000 |
| 4 |
4 |
|
[GLP]B:301 |
16 |
1 |
386 |
f |
B |
x,y,z |
1_555 |
43 |
19 |
13804 |
255.7 |
-2.7 |
0.595 |
15 |
0 |
0 |
0.000 |
5 |
|
[GLP]A:301 |
16 |
1 |
384 |
f |
A |
x,y,z |
1_555 |
44 |
19 |
13927 |
254.2 |
-2.7 |
0.594 |
15 |
0 |
0 |
0.000 |
| Average: |
254.9 |
-2.7 |
0.594 |
15 |
0 |
0 |
0.000 |
| 5 |
6 |
|
A |
29 |
7 |
13927 |
x |
A |
-y,x-y,z |
2_555 |
30 |
9 |
13927 |
233.7 |
-0.7 |
0.581 |
3 |
0 |
0 |
0.000 |
| 6 |
7 |
|
B |
25 |
8 |
13804 |
◊ |
A |
y-1,x,-z |
4_455 |
26 |
8 |
13927 |
233.7 |
-0.4 |
0.456 |
1 |
0 |
0 |
0.000 |
| 7 |
8 |
|
B |
16 |
7 |
13804 |
x |
B |
-y-1,x-y,z |
2_455 |
16 |
7 |
13804 |
142.8 |
-0.0 |
0.615 |
2 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[EDO]A:314 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
23 |
9 |
13927 |
114.0 |
3.8 |
0.515 |
1 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[EDO]B:310 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
24 |
9 |
13804 |
112.3 |
3.3 |
0.489 |
1 |
0 |
0 |
0.000 |
| 10 |
11 |
|
[EDO]A:302 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
23 |
12 |
13927 |
110.0 |
3.9 |
0.784 |
4 |
0 |
0 |
0.000 |
| 11 |
12 |
|
[EDO]A:309 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
13927 |
109.6 |
3.4 |
0.476 |
2 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[EDO]B:312 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
18 |
10 |
13804 |
107.0 |
3.5 |
0.736 |
2 |
0 |
0 |
0.000 |
| 13 |
14 |
|
B |
9 |
4 |
13804 |
x |
B |
-y,x-y+1,z |
2_565 |
13 |
7 |
13804 |
106.9 |
-1.2 |
0.226 |
0 |
1 |
0 |
0.000 |
15 |
|
A |
16 |
7 |
13927 |
x |
A |
-y,x-y+1,z |
2_565 |
6 |
2 |
13927 |
98.0 |
-1.1 |
0.234 |
0 |
0 |
0 |
0.000 |
| Average: |
102.5 |
-1.1 |
0.230 |
0 |
1 |
0 |
0.000 |
| 14 |
16 |
|
[EDO]B:309 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
20 |
5 |
13804 |
102.8 |
3.1 |
0.478 |
3 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[EDO]B:302 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
13804 |
101.4 |
3.6 |
0.518 |
4 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[EDO]A:304 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
13927 |
101.3 |
3.6 |
0.514 |
3 |
0 |
0 |
0.000 |
| 17 |
19 |
|
[EDO]B:307 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
13804 |
99.2 |
2.7 |
0.455 |
1 |
0 |
0 |
0.000 |
| 18 |
20 |
|
[EDO]A:312 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
14 |
4 |
13927 |
98.3 |
4.0 |
0.547 |
1 |
0 |
0 |
0.000 |
| 19 |
21 |
|
[EDO]A:303 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
13927 |
94.0 |
3.5 |
0.536 |
2 |
0 |
0 |
0.000 |
| 20 |
22 |
|
[EDO]A:308 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
15 |
7 |
13927 |
93.6 |
3.1 |
0.315 |
2 |
0 |
0 |
0.000 |
| 21 |
23 |
|
[EDO]B:306 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
10 |
7 |
13804 |
90.3 |
2.9 |
0.470 |
3 |
0 |
0 |
0.000 |
| 22 |
24 |
|
[EDO]B:305 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
13804 |
88.6 |
3.1 |
0.474 |
1 |
0 |
0 |
0.000 |
| 23 |
25 |
|
[EDO]B:308 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
13804 |
85.9 |
1.7 |
0.230 |
3 |
0 |
0 |
0.000 |
| 24 |
26 |
|
[EDO]A:310 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
13927 |
85.8 |
1.6 |
0.223 |
3 |
0 |
0 |
0.000 |
| 25 |
27 |
|
[EDO]A:305 |
3 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
15 |
7 |
13927 |
84.3 |
2.3 |
0.516 |
0 |
0 |
0 |
0.000 |
| 26 |
28 |
|
B |
11 |
4 |
13804 |
◊ |
A |
x-y,-y,-z |
5_555 |
8 |
2 |
13927 |
82.7 |
1.2 |
0.763 |
2 |
1 |
0 |
0.000 |
29 |
|
B |
4 |
2 |
13804 |
◊ |
A |
y-1/3,x+1/3,-z+1/3 |
10_455 |
7 |
3 |
13927 |
20.2 |
0.1 |
0.633 |
0 |
0 |
0 |
0.000 |
| Average: |
51.5 |
0.6 |
0.698 |
1 |
1 |
0 |
0.000 |
| 27 |
30 |
|
[EDO]A:313 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
10 |
7 |
13927 |
78.6 |
2.5 |
0.461 |
2 |
0 |
0 |
0.000 |
| 28 |
31 |
|
[EDO]B:304 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
4 |
13804 |
75.4 |
2.0 |
0.273 |
1 |
0 |
0 |
0.000 |
| 29 |
32 |
|
[EDO]A:307 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
13927 |
73.6 |
2.1 |
0.245 |
0 |
0 |
0 |
0.000 |
| 30 |
33 |
|
[EDO]A:311 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
13927 |
71.7 |
2.7 |
0.297 |
1 |
0 |
0 |
0.000 |
| 31 |
34 |
|
[EDO]A:306 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
13927 |
71.2 |
2.1 |
0.289 |
1 |
0 |
0 |
0.000 |
| 32 |
35 |
|
[EDO]B:311 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
13927 |
57.7 |
1.3 |
0.594 |
1 |
0 |
0 |
0.000 |
| 33 |
36 |
|
[EDO]B:311 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
13804 |
57.3 |
1.7 |
0.846 |
1 |
0 |
0 |
0.000 |
| 34 |
37 |
|
B |
7 |
3 |
13804 |
◊ |
[EDO]B:303 |
-y-1,x-y,z |
2_455 |
3 |
1 |
184 |
56.7 |
1.7 |
0.287 |
0 |
0 |
0 |
0.000 |
| 35 |
38 |
|
[EDO]B:303 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
13804 |
56.3 |
1.2 |
0.672 |
1 |
0 |
0 |
0.000 |
| 36 |
39 |
|
A |
9 |
3 |
13927 |
◊ |
A |
y-1/3,x+1/3,-z+1/3 |
10_455 |
9 |
3 |
13927 |
53.4 |
-0.7 |
0.470 |
0 |
0 |
0 |
0.000 |
40 |
|
B |
1 |
1 |
13804 |
◊ |
B |
x-y,-y,-z |
5_555 |
1 |
1 |
13804 |
22.3 |
-0.7 |
0.097 |
0 |
0 |
0 |
0.000 |
| Average: |
37.9 |
-0.7 |
0.283 |
0 |
0 |
0 |
0.000 |
| 37 |
41 |
|
[EDO]A:313 |
3 |
1 |
184 |
◊ |
B |
-y,x-y+1,z |
2_565 |
9 |
4 |
13804 |
51.2 |
1.2 |
0.258 |
1 |
0 |
0 |
0.000 |
| 38 |
42 |
|
A |
9 |
4 |
13927 |
f |
[EDO]B:306 |
-y,x-y+1,z |
2_565 |
3 |
1 |
183 |
48.9 |
0.7 |
0.598 |
0 |
0 |
0 |
0.000 |
| 39 |
43 |
|
[EDO]A:310 |
3 |
1 |
185 |
◊ |
B |
-y,x-y+1,z |
2_565 |
3 |
2 |
13804 |
47.3 |
2.5 |
0.982 |
1 |
0 |
0 |
0.000 |
| 40 |
44 |
|
[EDO]A:311 |
2 |
1 |
184 |
◊ |
B |
-y,x-y+1,z |
2_565 |
5 |
2 |
13804 |
45.6 |
1.6 |
0.642 |
0 |
0 |
0 |
0.000 |
| 41 |
45 |
|
[EDO]A:303 |
3 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
13804 |
44.5 |
0.9 |
0.750 |
0 |
0 |
0 |
0.000 |
| 42 |
46 |
|
A |
4 |
2 |
13927 |
◊ |
[EDO]B:308 |
-y,x-y+1,z |
2_565 |
4 |
1 |
186 |
44.5 |
2.3 |
0.982 |
1 |
0 |
0 |
0.000 |
| 43 |
47 |
|
[EDO]A:305 |
3 |
1 |
186 |
f |
A |
-y,x-y,z |
2_555 |
7 |
2 |
13927 |
41.8 |
1.1 |
0.789 |
1 |
0 |
0 |
0.000 |
| 44 |
48 |
|
[EDO]B:310 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
4 |
1 |
13927 |
38.4 |
1.5 |
0.958 |
1 |
0 |
0 |
0.000 |
| 45 |
49 |
|
[EDO]A:314 |
4 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
13804 |
35.6 |
1.5 |
0.953 |
0 |
0 |
0 |
0.000 |
| 46 |
50 |
|
[EDO]B:305 |
3 |
1 |
184 |
f |
[EDO]B:304 |
x,y,z |
1_555 |
2 |
1 |
185 |
33.7 |
1.2 |
1.000 |
2 |
0 |
0 |
0.000 |
| 47 |
51 |
|
[EDO]A:309 |
2 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
13804 |
32.2 |
0.7 |
0.602 |
1 |
0 |
0 |
0.000 |
| 48 |
52 |
|
[EDO]B:309 |
2 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
13927 |
31.1 |
0.6 |
0.580 |
0 |
0 |
0 |
0.000 |
| 49 |
53 |
|
[EDO]A:302 |
3 |
1 |
186 |
◊ |
[GLP]A:301 |
x,y,z |
1_555 |
4 |
1 |
384 |
29.2 |
0.9 |
0.823 |
1 |
0 |
0 |
0.000 |
| 50 |
54 |
|
[EDO]B:312 |
3 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
13927 |
25.5 |
0.2 |
0.678 |
0 |
0 |
0 |
0.000 |
| 51 |
55 |
|
[EDO]A:308 |
3 |
1 |
185 |
f |
[EDO]B:308 |
-y,x-y+1,z |
2_565 |
3 |
1 |
186 |
24.9 |
1.1 |
1.000 |
0 |
0 |
0 |
0.000 |
| 52 |
56 |
|
[EDO]A:313 |
4 |
1 |
184 |
f |
[EDO]A:311 |
x,y,z |
1_555 |
3 |
1 |
184 |
22.7 |
0.8 |
1.000 |
1 |
0 |
0 |
0.000 |
| 53 |
57 |
|
[EDO]A:312 |
3 |
1 |
184 |
f |
B |
-y,x-y+1,z |
2_565 |
1 |
1 |
13804 |
22.6 |
0.6 |
0.942 |
1 |
0 |
0 |
0.000 |
| 54 |
58 |
|
[EDO]B:312 |
1 |
1 |
185 |
◊ |
[GLP]B:301 |
x,y,z |
1_555 |
3 |
1 |
386 |
22.4 |
1.0 |
0.565 |
0 |
0 |
0 |
0.000 |
| 55 |
59 |
|
[EDO]B:305 |
3 |
1 |
184 |
f |
[EDO]B:303 |
x,y,z |
1_555 |
3 |
1 |
184 |
22.1 |
1.2 |
1.000 |
0 |
0 |
0 |
0.000 |
| 56 |
60 |
|
[EDO]A:302 |
1 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
13804 |
21.7 |
-0.0 |
0.600 |
0 |
0 |
0 |
0.000 |
| 57 |
61 |
|
[EDO]A:311 |
2 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
13804 |
21.1 |
0.1 |
0.528 |
0 |
0 |
0 |
0.000 |
| 58 |
62 |
|
A |
1 |
1 |
13927 |
◊ |
[EDO]B:309 |
-y,x-y+1,z |
2_565 |
1 |
1 |
185 |
15.5 |
0.7 |
0.655 |
0 |
0 |
0 |
0.000 |
| 59 |
63 |
|
[EDO]A:312 |
1 |
1 |
184 |
f |
[EDO]A:304 |
x,y,z |
1_555 |
1 |
1 |
184 |
4.7 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
| 60 |
64 |
|
[EDO]B:310 |
1 |
1 |
185 |
f |
[GLP]B:301 |
x,y,z |
1_555 |
1 |
1 |
386 |
3.3 |
-0.1 |
0.559 |
0 |
0 |
0 |
0.000 |
| 61 |
65 |
|
[EDO]A:314 |
1 |
1 |
186 |
f |
[GLP]A:301 |
x,y,z |
1_555 |
1 |
1 |
384 |
3.2 |
-0.1 |
0.559 |
0 |
0 |
0 |
0.000 |
| 62 |
66 |
|
[EDO]A:309 |
1 |
1 |
185 |
f |
B |
-y,x-y+1,z |
2_565 |
1 |
1 |
13804 |
3.1 |
0.2 |
0.878 |
0 |
0 |
0 |
0.000 |
|