| ## |
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 |
|
L |
227 |
64 |
11661 |
◊ |
H |
x,y,z |
1_555 |
207 |
56 |
12118 |
2024.8 |
-29.4 |
0.043 |
11 |
3 |
0 |
1.000 |
2 |
|
D |
198 |
55 |
11643 |
◊ |
C |
x,y,z |
1_555 |
206 |
56 |
11599 |
1833.3 |
-22.9 |
0.057 |
14 |
2 |
0 |
1.000 |
3 |
|
A |
75 |
19 |
17308 |
◊ |
H |
x,y,z |
1_555 |
56 |
14 |
12118 |
582.3 |
-4.0 |
0.523 |
7 |
0 |
0 |
0.000 |
4 |
|
A |
57 |
20 |
17308 |
◊ |
D |
x,y,z |
1_555 |
54 |
15 |
11643 |
572.1 |
-5.7 |
0.256 |
5 |
4 |
0 |
0.000 |
5 |
|
H |
56 |
18 |
12118 |
x |
H |
-x-1/2,y-1/2,-z-1 |
3_444 |
61 |
21 |
12118 |
539.1 |
-6.4 |
0.334 |
4 |
0 |
0 |
0.000 |
6 |
|
A |
49 |
22 |
17308 |
◊ |
A |
-x,-y+1,z |
2_565 |
49 |
22 |
17308 |
478.2 |
-4.2 |
0.375 |
2 |
2 |
0 |
0.000 |
7 |
|
L |
55 |
20 |
11661 |
◊ |
H |
-x-1/2,y-1/2,-z-1 |
3_444 |
44 |
16 |
12118 |
398.0 |
1.5 |
0.828 |
2 |
0 |
0 |
0.000 |
8 |
|
A |
40 |
15 |
17308 |
◊ |
A |
-x,-y,z |
2_555 |
40 |
15 |
17308 |
300.5 |
-4.3 |
0.297 |
0 |
0 |
0 |
0.000 |
9 |
|
C |
35 |
15 |
11599 |
◊ |
L |
-x-1/2,y-1/2,-z |
3_445 |
29 |
9 |
11661 |
288.7 |
-0.5 |
0.609 |
5 |
0 |
0 |
0.000 |
10 |
|
A |
26 |
10 |
17308 |
◊ |
L |
x,y,z |
1_555 |
25 |
9 |
11661 |
263.6 |
-5.7 |
0.074 |
0 |
0 |
0 |
0.000 |
11 |
|
[NAG]E:1 |
14 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
32 |
15 |
17308 |
212.4 |
4.5 |
0.462 |
3 |
0 |
0 |
0.000 |
12 |
|
D |
19 |
8 |
11643 |
◊ |
L |
-x-1/2,y-1/2,-z |
3_445 |
23 |
12 |
11661 |
169.5 |
-2.7 |
0.264 |
0 |
0 |
0 |
0.000 |
13 |
|
[NAG]B:1 |
13 |
1 |
355 |
cf |
A |
x,y,z |
1_555 |
24 |
11 |
17308 |
168.0 |
5.0 |
0.544 |
2 |
0 |
0 |
0.000 |
14 |
|
[NAG]A:503 |
12 |
1 |
354 |
cf |
A |
x,y,z |
1_555 |
23 |
8 |
17308 |
149.1 |
3.2 |
0.398 |
0 |
0 |
0 |
0.000 |
15 |
|
[NAG]A:504 |
11 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
18 |
7 |
17308 |
135.1 |
4.7 |
0.563 |
1 |
0 |
0 |
0.000 |
16 |
|
A |
19 |
7 |
17308 |
◊ |
C |
x,y,z |
1_555 |
12 |
2 |
11599 |
133.6 |
-2.8 |
0.171 |
1 |
0 |
0 |
0.000 |
17 |
|
D |
20 |
6 |
11643 |
◊ |
D |
-x,-y-1,z |
2_545 |
19 |
6 |
11643 |
129.4 |
-1.2 |
0.509 |
0 |
0 |
0 |
0.000 |
18 |
|
[NAG]E:2 |
11 |
1 |
355 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
17308 |
125.3 |
2.0 |
0.263 |
2 |
0 |
0 |
0.000 |
19 |
|
[NAG]I:1 |
10 |
1 |
347 |
cf |
A |
x,y,z |
1_555 |
14 |
4 |
17308 |
121.3 |
2.8 |
0.401 |
0 |
0 |
0 |
0.000 |
20 |
|
[NAG]A:502 |
12 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
15 |
4 |
17308 |
110.8 |
2.4 |
0.272 |
0 |
0 |
0 |
0.000 |
21 |
|
[NAG]F:1 |
10 |
1 |
356 |
cf |
A |
x,y,z |
1_555 |
13 |
7 |
17308 |
107.7 |
3.0 |
0.399 |
1 |
0 |
0 |
0.000 |
22 |
|
[NAG]G:1 |
9 |
1 |
346 |
cf |
A |
x,y,z |
1_555 |
15 |
7 |
17308 |
107.3 |
2.9 |
0.427 |
0 |
0 |
0 |
0.000 |
23 |
|
[NAG]A:505 |
8 |
1 |
351 |
cf |
A |
x,y,z |
1_555 |
15 |
8 |
17308 |
103.4 |
2.8 |
0.486 |
2 |
0 |
0 |
0.000 |
24 |
|
[MAN]E:4 |
9 |
1 |
287 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
17308 |
95.0 |
1.1 |
0.260 |
0 |
0 |
0 |
0.000 |
25 |
|
[NAG]A:507 |
7 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
8 |
4 |
17308 |
92.0 |
3.1 |
0.582 |
0 |
0 |
0 |
0.000 |
26 |
|
[NAG]A:506 |
10 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
14 |
6 |
17308 |
89.6 |
2.0 |
0.315 |
0 |
0 |
0 |
0.000 |
27 |
|
[NAG]G:2 |
9 |
1 |
362 |
cf |
[NAG]G:1 |
x,y,z |
1_555 |
9 |
1 |
346 |
83.8 |
2.2 |
0.075 |
1 |
0 |
0 |
0.000 |
28 |
|
[NAG]I:1 |
8 |
1 |
347 |
◊ |
H |
x,y,z |
1_555 |
12 |
4 |
12118 |
78.6 |
1.4 |
0.323 |
1 |
0 |
0 |
0.000 |
29 |
|
[NAG]E:2 |
10 |
1 |
355 |
cf |
[NAG]E:1 |
x,y,z |
1_555 |
6 |
1 |
360 |
76.2 |
2.1 |
0.113 |
1 |
0 |
0 |
0.000 |
30 |
|
[NAG]B:2 |
7 |
1 |
362 |
cf |
[NAG]B:1 |
x,y,z |
1_555 |
6 |
1 |
355 |
73.7 |
2.1 |
0.144 |
0 |
0 |
0 |
0.000 |
31 |
|
[NAG]I:2 |
8 |
1 |
360 |
cf |
[NAG]I:1 |
x,y,z |
1_555 |
7 |
1 |
347 |
71.5 |
1.3 |
0.076 |
0 |
0 |
0 |
0.000 |
32 |
|
[NAG]F:2 |
9 |
1 |
357 |
cf |
[NAG]F:1 |
x,y,z |
1_555 |
6 |
1 |
356 |
71.2 |
1.9 |
0.115 |
0 |
0 |
0 |
0.000 |
33 |
|
[NAG]A:501 |
7 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
5 |
2 |
17308 |
65.9 |
1.9 |
0.404 |
0 |
0 |
0 |
0.000 |
34 |
|
[NAG]I:2 |
5 |
1 |
360 |
◊ |
H |
x,y,z |
1_555 |
9 |
5 |
12118 |
64.6 |
2.3 |
0.605 |
0 |
0 |
0 |
0.000 |
35 |
|
[BMA]E:3 |
6 |
1 |
287 |
cf |
[NAG]E:2 |
x,y,z |
1_555 |
5 |
1 |
355 |
61.0 |
1.2 |
0.113 |
0 |
0 |
0 |
0.000 |
36 |
|
[BMA]F:3 |
5 |
1 |
288 |
cf |
[NAG]F:2 |
x,y,z |
1_555 |
5 |
1 |
357 |
59.7 |
1.8 |
0.182 |
0 |
0 |
0 |
0.000 |
37 |
|
[MAN]E:4 |
6 |
1 |
287 |
cf |
[BMA]E:3 |
x,y,z |
1_555 |
5 |
1 |
287 |
59.3 |
2.6 |
0.252 |
0 |
0 |
0 |
0.000 |
38 |
|
[NAG]F:1 |
7 |
1 |
356 |
f |
[NAG]A:505 |
x,y,z |
1_555 |
6 |
1 |
351 |
55.3 |
1.4 |
0.111 |
1 |
0 |
0 |
0.000 |
39 |
|
[MAN]E:5 |
6 |
1 |
288 |
cf |
[BMA]E:3 |
x,y,z |
1_555 |
4 |
1 |
287 |
53.2 |
2.3 |
0.246 |
0 |
0 |
0 |
0.000 |
40 |
|
D |
6 |
3 |
11643 |
◊ |
C |
x,y-1,z |
1_545 |
6 |
3 |
11599 |
41.2 |
0.7 |
0.779 |
0 |
0 |
0 |
0.000 |
41 |
|
[NAG]G:1 |
3 |
1 |
346 |
f |
[NAG]E:1 |
x,y,z |
1_555 |
5 |
1 |
360 |
41.0 |
1.5 |
0.274 |
1 |
0 |
0 |
0.000 |
42 |
|
[NAG]B:2 |
4 |
1 |
362 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
12118 |
41.0 |
1.3 |
0.353 |
2 |
0 |
0 |
0.000 |
43 |
|
H |
6 |
3 |
12118 |
◊ |
L |
-x-1/2,y-1/2,-z-1 |
3_444 |
5 |
3 |
11661 |
39.6 |
0.2 |
0.668 |
0 |
0 |
0 |
0.000 |
44 |
|
[NAG]A:504 |
3 |
1 |
361 |
f |
[NAG]A:503 |
x,y,z |
1_555 |
4 |
1 |
354 |
37.9 |
1.7 |
0.342 |
0 |
0 |
0 |
0.000 |
45 |
|
A |
3 |
1 |
17308 |
x |
A |
x,y-1,z |
1_545 |
4 |
1 |
17308 |
32.3 |
-0.1 |
0.585 |
1 |
0 |
0 |
0.000 |
46 |
|
[NAG]G:2 |
3 |
1 |
362 |
f |
A |
x,y,z |
1_555 |
5 |
5 |
17308 |
31.4 |
0.7 |
0.417 |
0 |
0 |
0 |
0.000 |
47 |
|
[NAG]I:2 |
5 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
17308 |
30.0 |
1.4 |
0.457 |
0 |
0 |
0 |
0.000 |
48 |
|
[NAG]A:502 |
3 |
1 |
362 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
12118 |
29.3 |
0.4 |
0.419 |
0 |
0 |
0 |
0.000 |
49 |
|
[NAG]A:507 |
5 |
1 |
364 |
◊ |
H |
x,y,z |
1_555 |
2 |
1 |
12118 |
29.3 |
-0.0 |
0.165 |
0 |
0 |
0 |
0.000 |
50 |
|
[NAG]A:501 |
2 |
1 |
362 |
◊ |
A |
-x,-y+1,z |
2_565 |
5 |
3 |
17308 |
26.9 |
0.8 |
0.648 |
0 |
0 |
0 |
0.000 |
51 |
|
[NAG]A:501 |
2 |
1 |
362 |
◊ |
[NAG]A:501 |
-x,-y+1,z |
2_565 |
2 |
1 |
362 |
25.9 |
0.7 |
0.235 |
0 |
0 |
0 |
0.000 |
52 |
|
[NAG]F:2 |
4 |
1 |
357 |
f |
[NAG]A:505 |
x,y,z |
1_555 |
2 |
1 |
351 |
24.7 |
0.3 |
0.158 |
1 |
0 |
0 |
0.000 |
53 |
|
[NAG]B:2 |
2 |
1 |
362 |
f |
[NAG]A:502 |
x,y,z |
1_555 |
2 |
1 |
362 |
20.4 |
1.2 |
0.449 |
0 |
0 |
0 |
0.000 |
54 |
|
[NAG]B:2 |
4 |
1 |
362 |
f |
A |
x,y,z |
1_555 |
5 |
4 |
17308 |
18.0 |
0.4 |
0.345 |
0 |
0 |
0 |
0.000 |
55 |
|
[BMA]E:3 |
2 |
1 |
287 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
17308 |
13.6 |
0.5 |
0.441 |
0 |
0 |
0 |
0.000 |
56 |
|
[MAN]E:4 |
1 |
1 |
287 |
f |
[NAG]E:2 |
x,y,z |
1_555 |
1 |
1 |
355 |
6.2 |
0.1 |
0.161 |
0 |
0 |
0 |
0.000 |
57 |
|
[NAG]G:1 |
1 |
1 |
346 |
f |
[NAG]E:2 |
x,y,z |
1_555 |
1 |
1 |
355 |
5.4 |
0.4 |
0.277 |
0 |
0 |
0 |
0.000 |
58 |
|
D |
1 |
1 |
11643 |
◊ |
[MAN]E:5 |
x,y-1,z |
1_545 |
2 |
1 |
288 |
1.9 |
-0.0 |
0.331 |
0 |
0 |
0 |
0.000 |
|