| ## |
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 |
268 |
70 |
24072 |
◊ |
A |
x,y,z |
1_555 |
274 |
71 |
23822 |
2499.7 |
-22.8 |
0.378 |
35 |
2 |
0 |
1.000 |
| 2 |
2 |
|
[COH]B:619 |
42 |
1 |
839 |
f |
B |
x,y,z |
1_555 |
69 |
26 |
24072 |
594.0 |
-19.1 |
0.482 |
4 |
0 |
0 |
1.000 |
| 3 |
3 |
|
[COH]A:621 |
43 |
1 |
811 |
f |
A |
x,y,z |
1_555 |
73 |
26 |
23822 |
577.9 |
-17.5 |
0.564 |
3 |
0 |
0 |
1.000 |
| 4 |
4 |
|
B |
44 |
17 |
24072 |
◊ |
A |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
51 |
17 |
23822 |
493.0 |
-3.1 |
0.504 |
4 |
0 |
0 |
0.000 |
| 5 |
5 |
|
[ACD]A:620 |
22 |
1 |
631 |
f |
A |
x,y,z |
1_555 |
64 |
27 |
23822 |
466.4 |
1.6 |
0.333 |
2 |
0 |
0 |
0.000 |
| 6 |
6 |
|
[ACD]B:1 |
22 |
1 |
633 |
f |
B |
x,y,z |
1_555 |
63 |
29 |
24072 |
452.5 |
2.3 |
0.339 |
0 |
0 |
0 |
0.000 |
| 7 |
7 |
|
B |
33 |
14 |
24072 |
◊ |
A |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
34 |
12 |
23822 |
294.8 |
-0.9 |
0.695 |
2 |
5 |
0 |
0.000 |
| 8 |
8 |
|
A |
37 |
14 |
23822 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
38 |
16 |
24072 |
289.9 |
-2.0 |
0.597 |
3 |
0 |
0 |
0.000 |
| 9 |
9 |
|
[BOG]A:703 |
19 |
1 |
516 |
◊ |
A |
x,y,z |
1_555 |
33 |
9 |
23822 |
237.6 |
4.9 |
0.340 |
3 |
0 |
0 |
0.000 |
| 10 |
10 |
|
B |
27 |
7 |
24072 |
f |
[BOG]A:703 |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
17 |
1 |
516 |
210.9 |
3.3 |
0.242 |
1 |
0 |
0 |
0.000 |
| 11 |
11 |
|
[NAG]B:681 |
12 |
1 |
364 |
cf |
B |
x,y,z |
1_555 |
22 |
8 |
24072 |
152.9 |
3.1 |
0.384 |
1 |
0 |
0 |
0.000 |
12 |
|
[NAG]A:681 |
12 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
26 |
8 |
23822 |
151.0 |
2.9 |
0.406 |
1 |
0 |
0 |
0.000 |
| Average: |
151.9 |
3.0 |
0.395 |
1 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[NAG]B:671 |
12 |
1 |
360 |
cf |
B |
x,y,z |
1_555 |
21 |
9 |
24072 |
136.2 |
3.6 |
0.357 |
1 |
0 |
0 |
0.000 |
14 |
|
[NAG]A:671 |
14 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
22 |
9 |
23822 |
133.4 |
3.6 |
0.318 |
1 |
0 |
0 |
0.000 |
| Average: |
134.8 |
3.6 |
0.337 |
1 |
0 |
0 |
0.000 |
| 13 |
15 |
|
[NAG]A:661 |
11 |
1 |
359 |
cf |
A |
x,y,z |
1_555 |
16 |
7 |
23822 |
128.9 |
3.4 |
0.413 |
1 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[NAG]B:661 |
13 |
1 |
364 |
cf |
B |
x,y,z |
1_555 |
16 |
7 |
24072 |
125.2 |
3.3 |
0.320 |
2 |
0 |
0 |
0.000 |
| 15 |
17 |
|
[EDO]B:2 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
21 |
11 |
24072 |
120.8 |
2.9 |
0.548 |
3 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[EDO]B:6 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
24072 |
115.0 |
3.5 |
0.474 |
3 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:4 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
23822 |
113.4 |
3.4 |
0.668 |
4 |
0 |
0 |
0.000 |
| Average: |
114.2 |
3.4 |
0.571 |
4 |
0 |
0 |
0.000 |
| 17 |
20 |
|
[EDO]A:619 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
21 |
11 |
23822 |
113.3 |
2.9 |
0.571 |
4 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[EDO]A:12 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
22 |
11 |
23822 |
109.8 |
3.8 |
0.688 |
6 |
0 |
0 |
0.000 |
| 19 |
22 |
|
[EDO]A:14 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
23822 |
109.2 |
4.0 |
0.560 |
1 |
0 |
0 |
0.000 |
| 20 |
23 |
|
[EDO]B:8 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
21 |
11 |
24072 |
108.7 |
3.7 |
0.679 |
6 |
0 |
0 |
0.000 |
| 21 |
24 |
|
[EDO]B:3 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
24072 |
107.0 |
3.5 |
0.521 |
2 |
0 |
0 |
0.000 |
| 22 |
25 |
|
[EDO]B:11 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
24072 |
105.6 |
4.0 |
0.566 |
4 |
0 |
0 |
0.000 |
| 23 |
26 |
|
[EDO]A:13 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
23822 |
105.4 |
3.0 |
0.519 |
2 |
0 |
0 |
0.000 |
| 24 |
27 |
|
[EDO]A:1 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
23822 |
101.6 |
2.4 |
0.470 |
3 |
0 |
0 |
0.000 |
| 25 |
28 |
|
[EDO]B:7 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
17 |
5 |
24072 |
87.6 |
1.2 |
0.363 |
0 |
0 |
0 |
0.000 |
| 26 |
29 |
|
[NAG]B:662 |
8 |
1 |
363 |
cf |
[NAG]B:661 |
x,y,z |
1_555 |
6 |
1 |
364 |
74.3 |
1.4 |
0.117 |
0 |
0 |
0 |
0.000 |
| 27 |
30 |
|
[NAG]B:672 |
8 |
1 |
355 |
cf |
[NAG]B:671 |
x,y,z |
1_555 |
6 |
1 |
360 |
70.6 |
1.6 |
0.094 |
0 |
0 |
0 |
0.000 |
| 28 |
31 |
|
[EDO]B:7 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
23822 |
70.5 |
1.5 |
0.234 |
1 |
0 |
0 |
0.000 |
| 29 |
32 |
|
[NAG]B:672 |
5 |
1 |
355 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
24072 |
69.8 |
2.0 |
0.574 |
0 |
0 |
0 |
0.000 |
| 30 |
33 |
|
[NAG]A:672 |
9 |
1 |
357 |
cf |
[NAG]A:671 |
x,y,z |
1_555 |
6 |
1 |
362 |
68.5 |
1.3 |
0.085 |
1 |
0 |
0 |
0.000 |
34 |
|
[NAG]A:662 |
10 |
1 |
363 |
cf |
[NAG]A:661 |
x,y,z |
1_555 |
6 |
1 |
359 |
65.6 |
1.3 |
0.087 |
1 |
0 |
0 |
0.000 |
| Average: |
67.0 |
1.3 |
0.086 |
1 |
0 |
0 |
0.000 |
| 31 |
35 |
|
[NAG]A:672 |
5 |
1 |
357 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
23822 |
67.8 |
2.2 |
0.601 |
0 |
0 |
0 |
0.000 |
| 32 |
36 |
|
[EDO]B:9 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
23822 |
64.3 |
1.6 |
0.190 |
0 |
0 |
0 |
0.000 |
| 33 |
37 |
|
[NAG]A:672 |
6 |
1 |
357 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
24072 |
63.5 |
1.2 |
0.346 |
0 |
0 |
0 |
0.000 |
| 34 |
38 |
|
[NAG]A:671 |
9 |
1 |
362 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
24072 |
63.3 |
0.1 |
0.118 |
0 |
0 |
0 |
0.000 |
39 |
|
[NAG]B:671 |
8 |
1 |
360 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
23822 |
59.2 |
0.1 |
0.110 |
0 |
0 |
0 |
0.000 |
| Average: |
61.3 |
0.1 |
0.114 |
0 |
0 |
0 |
0.000 |
| 35 |
40 |
|
[MAN]B:673 |
7 |
1 |
295 |
cf |
[NAG]B:672 |
x,y,z |
1_555 |
6 |
1 |
355 |
59.8 |
1.7 |
0.101 |
0 |
0 |
0 |
0.000 |
| 36 |
41 |
|
[NAG]B:672 |
5 |
1 |
355 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
23822 |
58.9 |
1.0 |
0.348 |
0 |
0 |
0 |
0.000 |
| 37 |
42 |
|
[MAN]A:673 |
6 |
1 |
291 |
cf |
[NAG]A:672 |
x,y,z |
1_555 |
5 |
1 |
357 |
58.2 |
2.0 |
0.188 |
0 |
0 |
0 |
0.000 |
| 38 |
43 |
|
[EDO]B:9 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
24072 |
57.8 |
0.8 |
0.659 |
1 |
0 |
0 |
0.000 |
| 39 |
44 |
|
[EDO]A:5 |
3 |
1 |
185 |
◊ |
[MAN]B:673 |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
3 |
1 |
295 |
37.1 |
1.1 |
0.524 |
1 |
0 |
0 |
0.000 |
| 40 |
45 |
|
[NAG]B:662 |
2 |
1 |
363 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
24072 |
30.4 |
0.8 |
0.565 |
0 |
0 |
0 |
0.000 |
| 41 |
46 |
|
[NAG]A:662 |
4 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
6 |
4 |
23822 |
30.3 |
0.8 |
0.425 |
0 |
0 |
0 |
0.000 |
| 42 |
47 |
|
[ACD]A:620 |
3 |
1 |
631 |
f |
[EDO]A:619 |
x,y,z |
1_555 |
2 |
1 |
184 |
17.6 |
0.8 |
0.594 |
0 |
0 |
0 |
0.000 |
| 43 |
48 |
|
[EDO]A:4 |
2 |
1 |
186 |
f |
[EDO]A:1 |
x,y,z |
1_555 |
2 |
1 |
185 |
15.6 |
0.8 |
1.000 |
0 |
0 |
0 |
0.000 |
| 44 |
49 |
|
[ACD]B:1 |
2 |
1 |
633 |
f |
[EDO]B:2 |
x,y,z |
1_555 |
3 |
1 |
186 |
10.8 |
0.7 |
0.622 |
0 |
0 |
0 |
0.000 |
| 45 |
50 |
|
[MAN]A:673 |
2 |
1 |
291 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
24072 |
6.1 |
0.3 |
0.457 |
0 |
0 |
0 |
0.000 |
| 46 |
51 |
|
[EDO]A:5 |
1 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
23822 |
6.1 |
0.1 |
0.532 |
0 |
0 |
0 |
0.000 |
| 47 |
52 |
|
[NAG]B:671 |
1 |
1 |
360 |
f |
[EDO]B:9 |
x,y,z |
1_555 |
2 |
1 |
184 |
5.0 |
0.2 |
0.535 |
0 |
0 |
0 |
0.000 |
| 48 |
53 |
|
B |
2 |
1 |
24072 |
◊ |
[MAN]B:673 |
x-1/2,-y+1/2,-z+1/2 |
8_455 |
1 |
1 |
295 |
3.0 |
-0.1 |
0.341 |
0 |
0 |
0 |
0.000 |
| 49 |
54 |
|
[MAN]B:673 |
1 |
1 |
295 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
23822 |
1.2 |
-0.0 |
0.299 |
0 |
0 |
0 |
0.000 |
|