## |
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 |
|
H |
190 |
51 |
12781 |
◊ |
L |
x,y,z |
1_555 |
181 |
46 |
11716 |
1618.0 |
-24.4 |
0.226 |
16 |
3 |
0 |
1.000 |
2 |
|
H |
37 |
10 |
12781 |
◊ |
A |
x,y,z |
1_555 |
41 |
11 |
9682 |
372.8 |
-3.2 |
0.456 |
6 |
0 |
0 |
0.000 |
3 |
|
L |
34 |
13 |
11716 |
x |
L |
x-1/2,-y-1/2,-z |
4_445 |
38 |
12 |
11716 |
325.0 |
-1.0 |
0.749 |
8 |
0 |
0 |
0.000 |
4 |
|
[NAG]A:200 |
13 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
16 |
7 |
9682 |
165.9 |
5.4 |
0.400 |
2 |
0 |
0 |
0.000 |
5 |
|
A |
18 |
5 |
9682 |
◊ |
H |
x-1/2,-y+1/2,-z |
4_455 |
21 |
7 |
12781 |
161.6 |
-2.6 |
0.306 |
0 |
0 |
0 |
0.000 |
6 |
|
[NAG]A:301 |
10 |
1 |
356 |
◊ |
H |
x,y,z |
1_555 |
22 |
8 |
12781 |
123.8 |
1.0 |
0.295 |
1 |
0 |
0 |
0.000 |
7 |
|
[NAG]A:300 |
11 |
1 |
357 |
cf |
A |
x,y,z |
1_555 |
12 |
5 |
9682 |
115.3 |
2.5 |
0.351 |
1 |
0 |
0 |
0.000 |
8 |
|
[MAN]A:215 |
7 |
1 |
290 |
◊ |
L |
x,y,z |
1_555 |
16 |
5 |
11716 |
106.2 |
1.6 |
0.451 |
5 |
0 |
0 |
0.000 |
9 |
|
[NAG]A:300 |
9 |
1 |
357 |
◊ |
H |
x,y,z |
1_555 |
18 |
7 |
12781 |
102.7 |
0.8 |
0.292 |
2 |
0 |
0 |
0.000 |
10 |
|
H |
13 |
5 |
12781 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
18 |
6 |
9682 |
101.7 |
0.5 |
0.772 |
1 |
0 |
0 |
0.000 |
11 |
|
[MAN]A:307 |
10 |
1 |
290 |
◊ |
H |
x,y,z |
1_555 |
15 |
6 |
12781 |
100.0 |
1.1 |
0.256 |
1 |
0 |
0 |
0.000 |
12 |
|
[MAN]A:237 |
8 |
1 |
292 |
◊ |
H |
x,y,z |
1_555 |
16 |
9 |
12781 |
94.8 |
1.6 |
0.332 |
1 |
0 |
0 |
0.000 |
13 |
|
[MAN]A:238 |
10 |
1 |
294 |
◊ |
H |
x,y,z |
1_555 |
12 |
5 |
12781 |
88.7 |
2.9 |
0.434 |
4 |
0 |
0 |
0.000 |
14 |
|
[MAN]A:303 |
6 |
1 |
289 |
◊ |
H |
x,y,z |
1_555 |
11 |
4 |
12781 |
80.7 |
1.0 |
0.396 |
1 |
0 |
0 |
0.000 |
15 |
|
[BMA]A:302 |
9 |
1 |
295 |
◊ |
H |
x,y,z |
1_555 |
12 |
4 |
12781 |
80.5 |
0.9 |
0.265 |
1 |
0 |
0 |
0.000 |
16 |
|
[NAG]A:201 |
8 |
1 |
363 |
cf |
[NAG]A:200 |
x,y,z |
1_555 |
7 |
1 |
362 |
78.9 |
2.1 |
0.108 |
1 |
0 |
0 |
0.000 |
17 |
|
[MAN]A:304 |
6 |
1 |
291 |
◊ |
H |
x,y,z |
1_555 |
9 |
4 |
12781 |
73.6 |
0.5 |
0.267 |
0 |
0 |
0 |
0.000 |
18 |
|
[NAG]A:301 |
9 |
1 |
356 |
cf |
[NAG]A:300 |
x,y,z |
1_555 |
7 |
1 |
357 |
71.6 |
1.6 |
0.100 |
0 |
0 |
0 |
0.000 |
19 |
|
[MAN]A:215 |
7 |
1 |
290 |
cf |
[MAN]A:214 |
x,y,z |
1_555 |
7 |
1 |
291 |
65.2 |
2.7 |
0.179 |
0 |
0 |
0 |
0.000 |
20 |
|
H |
7 |
3 |
12781 |
x |
H |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
12781 |
64.3 |
1.0 |
0.701 |
1 |
0 |
0 |
0.000 |
21 |
|
[BMA]A:302 |
6 |
1 |
295 |
cf |
[NAG]A:301 |
x,y,z |
1_555 |
5 |
1 |
356 |
60.2 |
1.4 |
0.144 |
0 |
0 |
0 |
0.000 |
22 |
|
[NAG]A:201 |
5 |
1 |
363 |
◊ |
H |
x,y,z |
1_555 |
12 |
2 |
12781 |
60.0 |
1.1 |
0.440 |
1 |
0 |
0 |
0.000 |
23 |
|
[MAN]A:303 |
5 |
1 |
289 |
cf |
[BMA]A:302 |
x,y,z |
1_555 |
6 |
1 |
295 |
59.5 |
2.7 |
0.264 |
0 |
0 |
0 |
0.000 |
24 |
|
[MAN]A:305 |
7 |
1 |
295 |
cf |
[MAN]A:304 |
x,y,z |
1_555 |
5 |
1 |
291 |
59.3 |
2.6 |
0.226 |
0 |
0 |
0 |
0.000 |
25 |
|
[MAN]A:237 |
7 |
1 |
292 |
cf |
[MAN]A:233 |
x,y,z |
1_555 |
6 |
1 |
294 |
58.8 |
2.5 |
0.189 |
0 |
0 |
0 |
0.000 |
26 |
|
[MAN]A:307 |
6 |
1 |
290 |
cf |
[MAN]A:304 |
x,y,z |
1_555 |
5 |
1 |
291 |
57.0 |
2.8 |
0.295 |
0 |
0 |
0 |
0.000 |
27 |
|
[MAN]A:234 |
5 |
1 |
292 |
cf |
[MAN]A:214 |
x,y,z |
1_555 |
7 |
1 |
291 |
55.7 |
2.5 |
0.233 |
0 |
0 |
0 |
0.000 |
28 |
|
[MAN]A:238 |
6 |
1 |
294 |
cf |
[MAN]A:237 |
x,y,z |
1_555 |
7 |
1 |
292 |
54.3 |
2.2 |
0.209 |
0 |
0 |
0 |
0.000 |
29 |
|
[BMA]A:232 |
5 |
1 |
292 |
◊ |
H |
x,y,z |
1_555 |
7 |
2 |
12781 |
53.8 |
1.2 |
0.463 |
0 |
0 |
0 |
0.000 |
30 |
|
[MAN]A:235 |
6 |
1 |
290 |
cf |
[MAN]A:234 |
x,y,z |
1_555 |
5 |
1 |
292 |
53.6 |
2.3 |
0.263 |
0 |
0 |
0 |
0.000 |
31 |
|
[BMA]A:232 |
6 |
1 |
292 |
cf |
[NAG]A:201 |
x,y,z |
1_555 |
4 |
1 |
363 |
53.4 |
0.7 |
0.105 |
0 |
0 |
0 |
0.000 |
32 |
|
[MAN]A:304 |
6 |
1 |
291 |
cf |
[BMA]A:302 |
x,y,z |
1_555 |
4 |
1 |
295 |
52.0 |
2.1 |
0.256 |
0 |
0 |
0 |
0.000 |
33 |
|
[NAG]A:200 |
6 |
1 |
362 |
◊ |
H |
x,y,z |
1_555 |
7 |
1 |
12781 |
50.6 |
1.0 |
0.369 |
1 |
0 |
0 |
0.000 |
34 |
|
[MAN]A:234 |
6 |
1 |
292 |
cf |
[BMA]A:232 |
x,y,z |
1_555 |
5 |
1 |
292 |
50.6 |
2.2 |
0.248 |
0 |
0 |
0 |
0.000 |
35 |
|
[MAN]A:233 |
6 |
1 |
294 |
cf |
[BMA]A:232 |
x,y,z |
1_555 |
6 |
1 |
292 |
50.6 |
2.1 |
0.202 |
0 |
0 |
0 |
0.000 |
36 |
|
[MAN]A:238 |
6 |
1 |
294 |
◊ |
L |
x,y,z |
1_555 |
5 |
2 |
11716 |
44.8 |
0.1 |
0.266 |
1 |
0 |
0 |
0.000 |
37 |
|
L |
6 |
2 |
11716 |
◊ |
[MAN]A:214 |
x-1/2,-y-1/2,-z |
4_445 |
4 |
1 |
291 |
43.9 |
0.9 |
0.369 |
1 |
0 |
0 |
0.000 |
38 |
|
[MAN]A:305 |
4 |
1 |
295 |
f |
[NAG]A:301 |
x,y,z |
1_555 |
4 |
1 |
356 |
42.5 |
2.1 |
0.327 |
1 |
0 |
0 |
0.000 |
39 |
|
[MAN]A:234 |
6 |
1 |
292 |
◊ |
L |
x,y,z |
1_555 |
7 |
2 |
11716 |
41.5 |
0.6 |
0.304 |
2 |
0 |
0 |
0.000 |
40 |
|
[MAN]A:304 |
6 |
1 |
291 |
f |
[NAG]A:301 |
x,y,z |
1_555 |
6 |
1 |
356 |
40.0 |
0.9 |
0.094 |
0 |
0 |
0 |
0.000 |
41 |
|
[NAG]A:201 |
6 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
4 |
1 |
9682 |
39.9 |
1.3 |
0.267 |
1 |
0 |
0 |
0.000 |
42 |
|
[MAN]A:233 |
5 |
1 |
294 |
◊ |
H |
x,y,z |
1_555 |
6 |
2 |
12781 |
39.0 |
0.7 |
0.315 |
0 |
0 |
0 |
0.000 |
43 |
|
[MAN]A:237 |
5 |
1 |
292 |
f |
[BMA]A:232 |
x,y,z |
1_555 |
5 |
1 |
292 |
38.1 |
0.4 |
0.102 |
1 |
0 |
0 |
0.000 |
44 |
|
[MAN]A:237 |
6 |
1 |
292 |
◊ |
L |
x,y,z |
1_555 |
7 |
1 |
11716 |
36.3 |
0.1 |
0.211 |
0 |
0 |
0 |
0.000 |
45 |
|
[MAN]A:214 |
4 |
1 |
291 |
◊ |
L |
x,y,z |
1_555 |
10 |
3 |
11716 |
36.1 |
1.3 |
0.507 |
0 |
0 |
0 |
0.000 |
46 |
|
L |
4 |
2 |
11716 |
◊ |
[MAN]A:235 |
x-1/2,-y-1/2,-z |
4_445 |
4 |
1 |
290 |
34.0 |
0.3 |
0.335 |
0 |
0 |
0 |
0.000 |
47 |
|
[BMA]A:232 |
4 |
1 |
292 |
◊ |
L |
x,y,z |
1_555 |
4 |
2 |
11716 |
30.5 |
-0.0 |
0.216 |
0 |
0 |
0 |
0.000 |
48 |
|
[MAN]A:238 |
4 |
1 |
294 |
f |
[MAN]A:214 |
x,y,z |
1_555 |
5 |
1 |
291 |
25.5 |
0.9 |
0.182 |
0 |
0 |
0 |
0.000 |
49 |
|
[MAN]A:238 |
4 |
1 |
294 |
f |
[MAN]A:233 |
x,y,z |
1_555 |
2 |
1 |
294 |
23.1 |
1.0 |
0.258 |
0 |
0 |
0 |
0.000 |
50 |
|
[MAN]A:215 |
2 |
1 |
290 |
◊ |
H |
x,y,z |
1_555 |
2 |
1 |
12781 |
22.7 |
-0.8 |
0.163 |
0 |
0 |
0 |
0.000 |
51 |
|
[MAN]A:238 |
2 |
1 |
294 |
f |
[MAN]A:215 |
x,y,z |
1_555 |
2 |
1 |
290 |
21.8 |
0.4 |
0.245 |
0 |
0 |
0 |
0.000 |
52 |
|
[MAN]A:238 |
2 |
1 |
294 |
f |
[MAN]A:234 |
x,y,z |
1_555 |
3 |
1 |
292 |
20.4 |
1.1 |
0.299 |
0 |
0 |
0 |
0.000 |
53 |
|
[MAN]A:234 |
2 |
1 |
292 |
f |
[MAN]A:215 |
x,y,z |
1_555 |
4 |
1 |
290 |
18.6 |
0.8 |
0.235 |
0 |
0 |
0 |
0.000 |
54 |
|
[MAN]A:234 |
2 |
1 |
292 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
12781 |
18.2 |
0.1 |
0.307 |
0 |
0 |
0 |
0.000 |
55 |
|
L |
1 |
1 |
11716 |
◊ |
[MAN]A:234 |
x-1/2,-y-1/2,-z |
4_445 |
3 |
1 |
292 |
17.6 |
0.9 |
0.493 |
0 |
0 |
0 |
0.000 |
56 |
|
[MAN]A:235 |
3 |
1 |
290 |
f |
[NAG]A:201 |
x,y,z |
1_555 |
3 |
1 |
363 |
16.5 |
0.5 |
0.206 |
0 |
0 |
0 |
0.000 |
57 |
|
[MAN]A:303 |
4 |
1 |
289 |
f |
[NAG]A:301 |
x,y,z |
1_555 |
3 |
1 |
356 |
13.0 |
0.5 |
0.201 |
0 |
0 |
0 |
0.000 |
58 |
|
[MAN]A:234 |
3 |
1 |
292 |
f |
[NAG]A:201 |
x,y,z |
1_555 |
1 |
1 |
363 |
11.9 |
0.5 |
0.282 |
0 |
0 |
0 |
0.000 |
59 |
|
[MAN]A:305 |
3 |
1 |
295 |
f |
[BMA]A:302 |
x,y,z |
1_555 |
1 |
1 |
295 |
11.7 |
0.5 |
0.222 |
0 |
0 |
0 |
0.000 |
60 |
|
L |
3 |
2 |
11716 |
◊ |
[MAN]A:215 |
x-1/2,-y-1/2,-z |
4_445 |
2 |
1 |
290 |
11.2 |
0.3 |
0.420 |
0 |
0 |
0 |
0.000 |
61 |
|
[MAN]A:235 |
2 |
1 |
290 |
f |
[BMA]A:232 |
x,y,z |
1_555 |
1 |
1 |
292 |
10.8 |
0.5 |
0.219 |
0 |
0 |
0 |
0.000 |
62 |
|
[MAN]A:238 |
1 |
1 |
294 |
f |
[BMA]A:232 |
x,y,z |
1_555 |
1 |
1 |
292 |
8.5 |
-0.1 |
0.182 |
0 |
0 |
0 |
0.000 |
63 |
|
H |
1 |
1 |
12781 |
◊ |
[MAN]A:303 |
x-1/2,-y+1/2,-z |
4_455 |
2 |
1 |
289 |
8.1 |
0.3 |
0.477 |
0 |
0 |
0 |
0.000 |
64 |
|
[MAN]A:305 |
1 |
1 |
295 |
f |
[NAG]A:300 |
x,y,z |
1_555 |
4 |
1 |
357 |
7.9 |
0.1 |
0.150 |
0 |
0 |
0 |
0.000 |
65 |
|
[MAN]A:305 |
1 |
1 |
295 |
◊ |
H |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
12781 |
3.7 |
0.1 |
0.372 |
0 |
0 |
0 |
0.000 |
66 |
|
[MAN]A:305 |
1 |
1 |
295 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
9682 |
2.5 |
-0.0 |
0.270 |
0 |
0 |
0 |
0.000 |
67 |
|
[MAN]A:233 |
1 |
1 |
294 |
◊ |
L |
x,y,z |
1_555 |
1 |
1 |
11716 |
2.2 |
0.1 |
0.280 |
0 |
0 |
0 |
0.000 |
68 |
|
[MAN]A:307 |
1 |
1 |
290 |
f |
[BMA]A:302 |
x,y,z |
1_555 |
1 |
1 |
295 |
0.3 |
0.0 |
0.182 |
0 |
0 |
0 |
0.000 |
|