| ## |
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 |
189 |
51 |
15581 |
◊ |
A |
x,y,z |
1_555 |
184 |
53 |
15478 |
1877.3 |
-19.4 |
0.057 |
26 |
7 |
0 |
1.000 |
2 |
|
B |
185 |
53 |
15581 |
◊ |
A |
-x,-x+y,-z+2/3 |
5_555 |
191 |
51 |
15478 |
1872.5 |
-19.8 |
0.058 |
25 |
6 |
0 |
1.000 |
| Average: |
1874.9 |
-19.6 |
0.058 |
26 |
7 |
0 |
1.000 |
| 2 |
3 |
|
[G39]B:1470 |
20 |
1 |
475 |
f |
B |
x,y,z |
1_555 |
42 |
18 |
15581 |
329.9 |
1.8 |
0.718 |
8 |
0 |
0 |
0.072 |
4 |
|
[G39]A:1470 |
20 |
1 |
472 |
f |
A |
x,y,z |
1_555 |
44 |
19 |
15478 |
329.8 |
2.2 |
0.742 |
8 |
0 |
0 |
0.072 |
| Average: |
329.9 |
2.0 |
0.730 |
8 |
0 |
0 |
0.072 |
| 3 |
5 |
|
B |
39 |
13 |
15581 |
◊ |
A |
y-1,x,-z |
4_455 |
35 |
14 |
15478 |
293.2 |
-0.4 |
0.600 |
4 |
0 |
0 |
0.000 |
| 4 |
6 |
|
B |
31 |
11 |
15581 |
◊ |
A |
x-y,-y+1,-z+1/3 |
6_565 |
36 |
9 |
15478 |
289.8 |
-4.9 |
0.132 |
0 |
3 |
0 |
0.000 |
| 5 |
7 |
|
[NAG]A:1467 |
12 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
25 |
7 |
15478 |
159.3 |
4.5 |
0.475 |
1 |
0 |
0 |
0.000 |
8 |
|
[NAG]B:1467 |
12 |
1 |
358 |
cf |
B |
x,y,z |
1_555 |
27 |
7 |
15581 |
153.1 |
3.4 |
0.379 |
1 |
0 |
0 |
0.000 |
| Average: |
156.2 |
3.9 |
0.427 |
1 |
0 |
0 |
0.000 |
| 6 |
9 |
|
B |
12 |
7 |
15581 |
◊ |
A |
-x,-x+y,-z-1/3 |
5_554 |
17 |
7 |
15478 |
138.1 |
1.0 |
0.778 |
1 |
1 |
0 |
0.000 |
| 7 |
10 |
|
B |
15 |
6 |
15581 |
x |
B |
-y,x-y+1,z-1/3 |
2_564 |
14 |
4 |
15581 |
114.1 |
-1.1 |
0.363 |
1 |
0 |
0 |
0.000 |
| 8 |
11 |
|
[EDO]B:1471 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
18 |
7 |
15581 |
113.9 |
3.5 |
0.490 |
2 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[EDO]B:1472 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
16 |
8 |
15581 |
111.5 |
4.0 |
0.523 |
1 |
0 |
0 |
0.000 |
| 10 |
13 |
|
[EDO]A:1473 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
15 |
8 |
15478 |
110.2 |
3.4 |
0.427 |
1 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[EDO]A:1480 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
21 |
8 |
15478 |
109.6 |
3.4 |
0.463 |
4 |
0 |
0 |
0.000 |
| 12 |
15 |
|
[EDO]A:1471 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
11 |
15478 |
105.6 |
2.8 |
0.470 |
2 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[EDO]B:1475 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
19 |
11 |
15581 |
103.5 |
2.9 |
0.448 |
1 |
0 |
0 |
0.000 |
| 14 |
17 |
|
[EDO]A:1474 |
4 |
1 |
184 |
◊ |
B |
-x,-x+y,-z+2/3 |
5_555 |
16 |
8 |
15581 |
96.5 |
3.2 |
0.458 |
4 |
0 |
0 |
0.000 |
| 15 |
18 |
|
[EDO]A:1472 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
16 |
8 |
15478 |
94.7 |
3.2 |
0.465 |
4 |
0 |
0 |
0.000 |
| 16 |
19 |
|
B |
16 |
9 |
15581 |
f |
[EDO]A:1479 |
y-1,x,-z |
4_455 |
4 |
1 |
184 |
90.9 |
1.9 |
0.227 |
2 |
0 |
0 |
0.000 |
| 17 |
20 |
|
B |
15 |
7 |
15581 |
f |
[EDO]A:1481 |
x-y,-y+1,-z+1/3 |
6_565 |
4 |
1 |
186 |
87.5 |
3.0 |
0.311 |
6 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[NAG]B:1469 |
9 |
1 |
364 |
cf |
B |
x,y,z |
1_555 |
7 |
2 |
15581 |
77.4 |
1.9 |
0.304 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
[EDO]A:1475 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
15478 |
76.8 |
2.4 |
0.311 |
1 |
0 |
0 |
0.000 |
| 20 |
23 |
|
[EDO]B:1476 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
15581 |
73.5 |
1.4 |
0.763 |
3 |
0 |
0 |
0.000 |
| 21 |
24 |
|
[NAG]A:1468 |
10 |
1 |
361 |
cf |
[NAG]A:1467 |
x,y,z |
1_555 |
6 |
1 |
361 |
72.3 |
1.8 |
0.088 |
0 |
0 |
0 |
0.000 |
| 22 |
25 |
|
[EDO]B:1473 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
15581 |
71.5 |
1.0 |
0.137 |
1 |
0 |
0 |
0.000 |
| 23 |
26 |
|
[NAG]A:1469 |
8 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
5 |
2 |
15478 |
71.0 |
2.5 |
0.434 |
0 |
0 |
0 |
0.000 |
| 24 |
27 |
|
[NAG]B:1468 |
9 |
1 |
358 |
cf |
[NAG]B:1467 |
x,y,z |
1_555 |
7 |
1 |
358 |
70.7 |
1.5 |
0.078 |
0 |
0 |
0 |
0.000 |
| 25 |
28 |
|
B |
13 |
5 |
15581 |
◊ |
[EDO]B:1474 |
-y,x-y+1,z-1/3 |
2_564 |
4 |
1 |
186 |
70.6 |
1.6 |
0.756 |
2 |
0 |
0 |
0.000 |
| 26 |
29 |
|
B |
8 |
3 |
15581 |
f |
[EDO]A:1476 |
x-y,-y+1,-z+1/3 |
6_565 |
4 |
1 |
185 |
69.2 |
1.3 |
0.639 |
3 |
0 |
0 |
0.000 |
| 27 |
30 |
|
[EDO]A:1478 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
15478 |
68.9 |
1.8 |
0.784 |
1 |
0 |
0 |
0.000 |
| 28 |
31 |
|
[NAG]B:1468 |
3 |
1 |
358 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
15581 |
65.3 |
1.2 |
0.511 |
0 |
0 |
0 |
0.000 |
| 29 |
32 |
|
[EDO]A:1477 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
15478 |
64.8 |
1.3 |
0.801 |
3 |
0 |
0 |
0.000 |
| 30 |
33 |
|
B |
9 |
3 |
15581 |
◊ |
[EDO]A:1475 |
x-y,-y+1,-z+1/3 |
6_565 |
4 |
1 |
184 |
63.3 |
0.9 |
0.444 |
0 |
0 |
0 |
0.000 |
| 31 |
34 |
|
A |
7 |
2 |
15478 |
x |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
7 |
3 |
15478 |
62.4 |
1.2 |
0.777 |
0 |
0 |
0 |
0.000 |
| 32 |
35 |
|
[EDO]A:1479 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
15478 |
61.9 |
1.7 |
0.264 |
1 |
0 |
0 |
0.000 |
| 33 |
36 |
|
[EDO]A:1476 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
15478 |
60.8 |
1.6 |
0.274 |
0 |
0 |
0 |
0.000 |
| 34 |
37 |
|
[EDO]B:1474 |
3 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
15581 |
60.6 |
2.0 |
0.275 |
2 |
0 |
0 |
0.000 |
| 35 |
38 |
|
[NAG]A:1468 |
4 |
1 |
361 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
15478 |
56.6 |
1.5 |
0.524 |
0 |
0 |
0 |
0.000 |
| 36 |
39 |
|
B |
7 |
3 |
15581 |
◊ |
[EDO]A:1477 |
y-1,x,-z |
4_455 |
4 |
1 |
184 |
51.7 |
0.9 |
0.618 |
1 |
0 |
0 |
0.000 |
| 37 |
40 |
|
[EDO]A:1481 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
15478 |
46.3 |
1.6 |
0.805 |
0 |
0 |
0 |
0.000 |
| 38 |
41 |
|
[CA]B:1466 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
8 |
6 |
15581 |
43.8 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.548 |
42 |
|
[CA]A:1466 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
7 |
6 |
15478 |
43.6 |
-13.0 |
0.000 |
0 |
0 |
0 |
0.548 |
| Average: |
43.7 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.548 |
| 39 |
43 |
|
[EDO]A:1474 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
15478 |
41.9 |
0.4 |
0.481 |
0 |
0 |
0 |
0.000 |
| 40 |
44 |
|
[EDO]B:1473 |
4 |
1 |
182 |
◊ |
A |
-x,-x+y,-z+2/3 |
5_555 |
5 |
1 |
15478 |
41.1 |
1.1 |
0.816 |
0 |
0 |
0 |
0.000 |
| 41 |
45 |
|
[EDO]A:1472 |
3 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
15581 |
40.5 |
0.5 |
0.478 |
0 |
0 |
0 |
0.000 |
| 42 |
46 |
|
[EDO]B:1471 |
2 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
15478 |
37.6 |
1.8 |
0.976 |
1 |
0 |
0 |
0.000 |
| 43 |
47 |
|
[EDO]B:1472 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
15478 |
33.5 |
1.6 |
0.987 |
1 |
0 |
0 |
0.000 |
| 44 |
48 |
|
[EDO]A:1473 |
4 |
1 |
183 |
f |
B |
-x,-x+y,-z+2/3 |
5_555 |
2 |
1 |
15581 |
32.0 |
1.6 |
0.988 |
1 |
0 |
0 |
0.000 |
| 45 |
49 |
|
[EDO]B:1476 |
2 |
1 |
184 |
◊ |
A |
x-y,-y+1,-z+1/3 |
6_565 |
4 |
1 |
15478 |
31.1 |
1.4 |
0.647 |
0 |
0 |
0 |
0.000 |
| 46 |
50 |
|
[EDO]A:1480 |
2 |
1 |
183 |
f |
[G39]A:1470 |
x,y,z |
1_555 |
5 |
1 |
472 |
26.7 |
0.5 |
0.812 |
0 |
0 |
0 |
0.000 |
| 47 |
51 |
|
[EDO]B:1475 |
2 |
1 |
185 |
◊ |
[EDO]B:1474 |
x,y,z |
1_555 |
2 |
1 |
186 |
24.9 |
1.6 |
1.000 |
0 |
0 |
0 |
0.000 |
| 48 |
52 |
|
B |
3 |
1 |
15581 |
f |
[EDO]B:1475 |
-y,x-y+1,z-1/3 |
2_564 |
3 |
1 |
185 |
23.7 |
0.2 |
0.602 |
0 |
0 |
0 |
0.000 |
| 49 |
53 |
|
[EDO]A:1481 |
3 |
1 |
186 |
◊ |
[EDO]A:1475 |
x,y,z |
1_555 |
2 |
1 |
184 |
21.6 |
1.0 |
1.000 |
0 |
0 |
0 |
0.000 |
| 50 |
54 |
|
B |
2 |
2 |
15581 |
◊ |
B |
-x,-x+y,-z+2/3 |
5_555 |
2 |
2 |
15581 |
10.8 |
0.3 |
0.787 |
0 |
0 |
0 |
0.000 |
55 |
|
A |
2 |
2 |
15478 |
◊ |
A |
-x,-x+y,-z+2/3 |
5_555 |
2 |
2 |
15478 |
9.1 |
0.2 |
0.763 |
0 |
0 |
0 |
0.000 |
| Average: |
9.9 |
0.3 |
0.775 |
0 |
0 |
0 |
0.000 |
| 51 |
56 |
|
[EDO]B:1476 |
1 |
1 |
184 |
f |
A |
y-1,x,-z |
4_455 |
1 |
1 |
15478 |
2.5 |
0.0 |
0.638 |
0 |
0 |
0 |
0.000 |
|