| ## |
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 |
47 |
17741 |
◊ |
A |
x,y,z |
1_555 |
170 |
48 |
17985 |
1619.2 |
-18.2 |
0.047 |
18 |
2 |
0 |
0.260 |
| 2 |
2 |
|
B |
67 |
20 |
17741 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
65 |
17 |
17985 |
567.8 |
-0.1 |
0.687 |
4 |
0 |
0 |
0.000 |
| 3 |
3 |
|
B |
56 |
21 |
17741 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
61 |
22 |
17985 |
511.3 |
1.3 |
0.780 |
11 |
2 |
0 |
0.005 |
| 4 |
4 |
|
B |
52 |
16 |
17741 |
x |
B |
-x-1/2,-y,z-1/2 |
2_454 |
57 |
20 |
17741 |
511.2 |
-3.8 |
0.306 |
3 |
0 |
0 |
0.000 |
| 5 |
5 |
|
A |
59 |
16 |
17985 |
x |
A |
-x-1/2,-y+1,z-1/2 |
2_464 |
53 |
17 |
17985 |
503.1 |
-3.6 |
0.371 |
3 |
0 |
0 |
0.000 |
| 6 |
6 |
|
[8LM]A:610 |
32 |
1 |
677 |
f |
A |
x,y,z |
1_555 |
71 |
28 |
17985 |
477.9 |
-2.6 |
0.665 |
8 |
0 |
0 |
0.136 |
7 |
|
[8LM]B:610 |
30 |
1 |
670 |
f |
B |
x,y,z |
1_555 |
72 |
26 |
17741 |
453.3 |
-1.4 |
0.699 |
9 |
0 |
0 |
0.136 |
| Average: |
465.6 |
-2.0 |
0.682 |
9 |
0 |
0 |
0.136 |
| 7 |
8 |
|
[8LM]A:611 |
24 |
1 |
672 |
◊ |
A |
x,y,z |
1_555 |
37 |
13 |
17985 |
282.5 |
-0.8 |
0.712 |
6 |
0 |
0 |
0.034 |
| 8 |
9 |
|
A |
23 |
8 |
17985 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
18 |
6 |
17985 |
213.4 |
-0.6 |
0.460 |
3 |
0 |
0 |
0.000 |
| 9 |
10 |
|
B |
15 |
6 |
17741 |
◊ |
A |
-x-1/2,-y+1,z-1/2 |
2_464 |
36 |
10 |
17985 |
203.5 |
2.3 |
0.852 |
2 |
0 |
0 |
0.000 |
| 10 |
11 |
|
[8LM]A:611 |
16 |
1 |
672 |
f |
B |
x,y,z |
1_555 |
21 |
8 |
17741 |
184.2 |
-2.7 |
0.437 |
2 |
0 |
0 |
0.036 |
| 11 |
12 |
|
[NAG]A:602 |
14 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
19 |
7 |
17985 |
141.7 |
2.9 |
0.278 |
1 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[NAG]B:602 |
13 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
19 |
7 |
17741 |
141.3 |
3.2 |
0.311 |
1 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[GOL]B:608 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
17741 |
122.2 |
-1.4 |
0.345 |
1 |
0 |
0 |
0.018 |
| 14 |
15 |
|
[NAG]A:606 |
11 |
1 |
348 |
cf |
A |
x,y,z |
1_555 |
12 |
4 |
17985 |
115.9 |
3.7 |
0.449 |
0 |
0 |
0 |
0.000 |
| 15 |
16 |
|
[SO4]B:609 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
19 |
8 |
17741 |
111.7 |
-16.9 |
0.843 |
7 |
0 |
0 |
0.196 |
| 16 |
17 |
|
[EDO]B:607 |
4 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
14 |
7 |
17741 |
93.4 |
2.9 |
0.564 |
0 |
0 |
0 |
0.000 |
| 17 |
18 |
|
[NAG]B:605 |
11 |
1 |
361 |
cf |
B |
x,y,z |
1_555 |
8 |
3 |
17741 |
93.1 |
2.3 |
0.300 |
0 |
0 |
0 |
0.000 |
| 18 |
19 |
|
[NAG]B:603 |
10 |
1 |
357 |
f |
B |
x,y,z |
1_555 |
11 |
2 |
17741 |
90.2 |
0.9 |
0.131 |
0 |
0 |
0 |
0.000 |
| 19 |
20 |
|
[EDO]A:608 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
17 |
6 |
17985 |
89.3 |
2.9 |
0.302 |
1 |
0 |
0 |
0.000 |
| 20 |
21 |
|
[NAG]A:603 |
10 |
1 |
361 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
17985 |
88.2 |
1.1 |
0.163 |
0 |
0 |
0 |
0.000 |
| 21 |
22 |
|
[EDO]A:607 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
17985 |
87.3 |
2.5 |
0.271 |
1 |
0 |
0 |
0.000 |
| 22 |
23 |
|
B |
6 |
2 |
17741 |
◊ |
[NAG]A:603 |
-x-1/2,-y+1,z-1/2 |
2_464 |
9 |
1 |
361 |
86.8 |
1.7 |
0.264 |
2 |
0 |
0 |
0.000 |
| 23 |
24 |
|
[MAN]A:605 |
7 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
17985 |
85.7 |
0.4 |
0.221 |
1 |
0 |
0 |
0.000 |
| 24 |
25 |
|
[SO4]B:606 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
17741 |
76.8 |
-10.2 |
0.902 |
5 |
0 |
0 |
0.122 |
| 25 |
26 |
|
[NAG]A:603 |
9 |
1 |
361 |
cf |
[NAG]A:602 |
x,y,z |
1_555 |
6 |
1 |
362 |
73.2 |
1.5 |
0.095 |
0 |
0 |
0 |
0.000 |
27 |
|
[NAG]B:603 |
9 |
1 |
357 |
cf |
[NAG]B:602 |
x,y,z |
1_555 |
7 |
1 |
363 |
72.8 |
1.6 |
0.073 |
1 |
0 |
0 |
0.000 |
| Average: |
73.0 |
1.6 |
0.084 |
1 |
0 |
0 |
0.000 |
| 26 |
28 |
|
B |
12 |
7 |
17741 |
f |
[SO4]A:609 |
-x-1,y-1/2,-z-1/2 |
3_444 |
5 |
1 |
185 |
69.9 |
-10.8 |
0.675 |
1 |
0 |
0 |
0.110 |
| 27 |
29 |
|
[SO4]A:609 |
5 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
17985 |
69.6 |
-10.4 |
0.782 |
1 |
0 |
0 |
0.014 |
| 28 |
30 |
|
[SO4]B:606 |
5 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
17985 |
69.3 |
-10.3 |
0.687 |
3 |
0 |
0 |
0.114 |
| 29 |
31 |
|
[BMA]B:604 |
7 |
1 |
294 |
cf |
[NAG]B:603 |
x,y,z |
1_555 |
5 |
1 |
357 |
61.0 |
1.3 |
0.115 |
0 |
0 |
0 |
0.000 |
| 30 |
32 |
|
[BMA]A:604 |
5 |
1 |
292 |
cf |
[NAG]A:603 |
x,y,z |
1_555 |
5 |
1 |
361 |
57.8 |
1.3 |
0.156 |
0 |
0 |
0 |
0.000 |
| 31 |
33 |
|
[MAN]A:605 |
7 |
1 |
293 |
cf |
[BMA]A:604 |
x,y,z |
1_555 |
6 |
1 |
292 |
56.8 |
2.3 |
0.172 |
0 |
0 |
0 |
0.000 |
| 32 |
34 |
|
[EDO]A:608 |
4 |
1 |
185 |
f |
A |
-x-1/2,-y+1,z-1/2 |
2_464 |
5 |
2 |
17985 |
50.4 |
0.7 |
0.423 |
1 |
0 |
0 |
0.000 |
| 33 |
35 |
|
B |
6 |
2 |
17741 |
x |
B |
x-1/2,-y+1/2,-z-1 |
4_454 |
3 |
1 |
17741 |
47.9 |
1.3 |
0.870 |
0 |
0 |
0 |
0.000 |
| 34 |
36 |
|
[BMA]A:604 |
4 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
17985 |
43.7 |
0.3 |
0.231 |
0 |
0 |
0 |
0.000 |
| 35 |
37 |
|
[CA]A:601 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
4 |
4 |
17985 |
42.8 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.281 |
38 |
|
[CA]B:601 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
3 |
3 |
17741 |
42.7 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.281 |
| Average: |
42.7 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.281 |
| 36 |
39 |
|
[EDO]B:607 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
17985 |
41.5 |
0.4 |
0.702 |
3 |
0 |
0 |
0.021 |
| 37 |
40 |
|
[BMA]B:604 |
5 |
1 |
294 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
17741 |
37.9 |
-0.3 |
0.168 |
0 |
0 |
0 |
0.003 |
| 38 |
41 |
|
A |
3 |
1 |
17985 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
3 |
1 |
17741 |
32.8 |
0.4 |
0.705 |
1 |
0 |
0 |
0.000 |
| 39 |
42 |
|
B |
7 |
3 |
17741 |
◊ |
[NAG]A:602 |
-x-1/2,-y+1,z-1/2 |
2_464 |
5 |
1 |
362 |
32.0 |
0.4 |
0.289 |
0 |
0 |
0 |
0.000 |
| 40 |
43 |
|
B |
4 |
3 |
17741 |
◊ |
[BMA]A:604 |
-x-1/2,-y+1,z-1/2 |
2_464 |
5 |
1 |
292 |
30.0 |
0.7 |
0.316 |
0 |
0 |
0 |
0.000 |
| 41 |
44 |
|
B |
4 |
1 |
17741 |
◊ |
[NAG]A:602 |
-x-1,y-1/2,-z-1/2 |
3_444 |
2 |
1 |
362 |
18.3 |
0.4 |
0.425 |
0 |
0 |
0 |
0.000 |
| 42 |
45 |
|
[NAG]B:602 |
1 |
1 |
363 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
3 |
1 |
17985 |
17.8 |
0.3 |
0.459 |
0 |
0 |
0 |
0.000 |
| 43 |
46 |
|
[NAG]A:606 |
1 |
1 |
348 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
17741 |
10.4 |
0.5 |
0.695 |
0 |
0 |
0 |
0.000 |
| 44 |
47 |
|
[BMA]B:604 |
2 |
1 |
294 |
◊ |
A |
-x-1/2,-y,z-1/2 |
2_454 |
2 |
1 |
17985 |
7.4 |
0.1 |
0.313 |
0 |
0 |
0 |
0.000 |
| 45 |
48 |
|
[MAN]A:605 |
4 |
1 |
293 |
f |
[NAG]A:603 |
x,y,z |
1_555 |
2 |
1 |
361 |
7.3 |
0.4 |
0.147 |
0 |
0 |
0 |
0.000 |
|