## |
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 |
|
D |
106 |
29 |
11822 |
◊ |
C |
x,y,z |
1_555 |
105 |
31 |
11455 |
1056.1 |
-11.4 |
0.166 |
6 |
6 |
0 |
0.000 |
2 |
2 |
|
D |
82 |
20 |
11822 |
◊ |
B |
x,y,z |
1_555 |
99 |
31 |
9864 |
850.6 |
-0.2 |
0.707 |
13 |
9 |
0 |
0.000 |
3 |
|
C |
79 |
22 |
11455 |
◊ |
A |
x,y,z |
1_555 |
97 |
32 |
10479 |
821.4 |
-0.6 |
0.633 |
8 |
7 |
0 |
0.000 |
Average: |
836.0 |
-0.4 |
0.670 |
11 |
8 |
0 |
0.000 |
3 |
4 |
|
C |
46 |
13 |
11455 |
x |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
49 |
13 |
11455 |
426.3 |
0.0 |
0.699 |
4 |
0 |
0 |
0.000 |
4 |
5 |
|
C |
29 |
11 |
11455 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
26 |
10 |
11822 |
266.7 |
1.8 |
0.793 |
4 |
0 |
0 |
0.000 |
5 |
6 |
|
D |
30 |
7 |
11822 |
x |
D |
-x,y-1/2,-z+1/2 |
3_545 |
31 |
8 |
11822 |
250.4 |
-2.4 |
0.449 |
1 |
0 |
0 |
0.000 |
6 |
7 |
|
A |
22 |
8 |
10479 |
◊ |
B |
-x+1,y-1/2,-z+1/2 |
3_645 |
18 |
8 |
9864 |
163.9 |
-0.3 |
0.653 |
2 |
0 |
0 |
0.000 |
7 |
8 |
|
D |
17 |
7 |
11822 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
22 |
9 |
9864 |
142.6 |
-0.4 |
0.656 |
0 |
0 |
0 |
0.000 |
8 |
9 |
|
[NAG]D:501 |
13 |
1 |
354 |
cf |
D |
x,y,z |
1_555 |
18 |
6 |
11822 |
129.4 |
2.1 |
0.262 |
1 |
0 |
0 |
0.000 |
9 |
10 |
|
[NAG]C:501 |
13 |
1 |
354 |
cf |
C |
x,y,z |
1_555 |
14 |
5 |
11455 |
125.4 |
2.5 |
0.225 |
0 |
0 |
0 |
0.000 |
10 |
11 |
|
[NAG]D:507 |
10 |
1 |
361 |
f |
D |
x,y,z |
1_555 |
16 |
6 |
11822 |
122.9 |
1.1 |
0.192 |
0 |
0 |
0 |
0.000 |
11 |
12 |
|
[NAG]C:507 |
8 |
1 |
361 |
f |
C |
x,y,z |
1_555 |
17 |
6 |
11455 |
108.2 |
1.0 |
0.246 |
0 |
0 |
0 |
0.000 |
12 |
13 |
|
[NAG]C:502 |
12 |
1 |
359 |
f |
C |
x,y,z |
1_555 |
14 |
7 |
11455 |
104.5 |
1.6 |
0.199 |
2 |
0 |
0 |
0.000 |
13 |
14 |
|
[NAG]D:502 |
11 |
1 |
364 |
f |
D |
x,y,z |
1_555 |
18 |
8 |
11822 |
96.6 |
0.5 |
0.138 |
0 |
0 |
0 |
0.000 |
14 |
15 |
|
[MAN]D:506 |
8 |
1 |
290 |
cf |
[NAG]D:507 |
x,y,z |
1_555 |
6 |
1 |
361 |
76.1 |
2.9 |
0.184 |
1 |
0 |
0 |
0.000 |
15 |
16 |
|
[NAG]C:502 |
8 |
1 |
359 |
cf |
[NAG]C:501 |
x,y,z |
1_555 |
6 |
1 |
354 |
69.0 |
2.0 |
0.132 |
1 |
0 |
0 |
0.000 |
16 |
17 |
|
[MAN]D:504 |
7 |
1 |
290 |
cf |
[NAG]D:505 |
x,y,z |
1_555 |
6 |
1 |
355 |
68.8 |
2.7 |
0.213 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
[NAG]D:502 |
9 |
1 |
364 |
cf |
[NAG]D:501 |
x,y,z |
1_555 |
7 |
1 |
354 |
68.1 |
1.6 |
0.098 |
1 |
0 |
0 |
0.000 |
18 |
19 |
|
[MAN]C:506 |
7 |
1 |
293 |
cf |
[NAG]C:507 |
x,y,z |
1_555 |
8 |
1 |
361 |
67.2 |
2.4 |
0.131 |
0 |
0 |
0 |
0.000 |
19 |
20 |
|
[MAN]C:504 |
9 |
1 |
294 |
cf |
[NAG]C:505 |
x,y,z |
1_555 |
7 |
1 |
351 |
65.9 |
2.3 |
0.109 |
0 |
0 |
0 |
0.000 |
20 |
21 |
|
[BMA]D:503 |
8 |
1 |
291 |
f |
D |
x,y,z |
1_555 |
9 |
2 |
11822 |
64.6 |
0.7 |
0.163 |
0 |
0 |
0 |
0.000 |
21 |
22 |
|
[BMA]C:503 |
7 |
1 |
289 |
f |
C |
x,y,z |
1_555 |
9 |
2 |
11455 |
61.1 |
0.7 |
0.222 |
0 |
0 |
0 |
0.000 |
22 |
23 |
|
[MAN]C:506 |
4 |
1 |
293 |
f |
C |
x,y,z |
1_555 |
4 |
2 |
11455 |
59.0 |
2.0 |
0.631 |
1 |
0 |
0 |
0.000 |
23 |
24 |
|
[NAG]D:505 |
6 |
1 |
355 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
11822 |
57.7 |
0.5 |
0.227 |
0 |
0 |
0 |
0.000 |
24 |
25 |
|
[FUC]D:508 |
7 |
1 |
280 |
cf |
[NAG]D:501 |
x,y,z |
1_555 |
5 |
1 |
354 |
57.5 |
2.4 |
0.215 |
0 |
0 |
0 |
0.000 |
25 |
26 |
|
[FUC]C:508 |
5 |
1 |
282 |
cf |
[NAG]C:501 |
x,y,z |
1_555 |
5 |
1 |
354 |
57.2 |
2.3 |
0.272 |
0 |
0 |
0 |
0.000 |
26 |
27 |
|
[MAN]C:504 |
8 |
1 |
294 |
cf |
[BMA]C:503 |
x,y,z |
1_555 |
5 |
1 |
289 |
55.4 |
2.3 |
0.228 |
0 |
0 |
0 |
0.000 |
27 |
28 |
|
[MAN]C:506 |
7 |
1 |
293 |
f |
[NAG]C:502 |
x,y,z |
1_555 |
7 |
1 |
359 |
55.3 |
0.9 |
0.077 |
0 |
0 |
0 |
0.000 |
28 |
29 |
|
[BMA]D:503 |
6 |
1 |
291 |
cf |
[NAG]D:502 |
x,y,z |
1_555 |
5 |
1 |
364 |
54.2 |
0.9 |
0.112 |
1 |
0 |
0 |
0.000 |
30 |
|
[BMA]C:503 |
5 |
1 |
289 |
cf |
[NAG]C:502 |
x,y,z |
1_555 |
5 |
1 |
359 |
50.8 |
1.0 |
0.155 |
1 |
0 |
0 |
0.000 |
Average: |
52.5 |
0.9 |
0.133 |
1 |
0 |
0 |
0.000 |
29 |
31 |
|
[MAN]D:506 |
6 |
1 |
290 |
f |
[NAG]D:502 |
x,y,z |
1_555 |
6 |
1 |
364 |
51.2 |
1.8 |
0.171 |
0 |
0 |
0 |
0.000 |
30 |
32 |
|
[MAN]D:504 |
7 |
1 |
290 |
cf |
[BMA]D:503 |
x,y,z |
1_555 |
6 |
1 |
291 |
50.7 |
2.3 |
0.209 |
0 |
0 |
0 |
0.000 |
31 |
33 |
|
[MAN]C:506 |
7 |
1 |
293 |
cf |
[BMA]C:503 |
x,y,z |
1_555 |
4 |
1 |
289 |
50.5 |
1.8 |
0.230 |
0 |
0 |
0 |
0.000 |
32 |
34 |
|
[NAG]D:501 |
4 |
1 |
354 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
12 |
3 |
11822 |
48.6 |
1.5 |
0.575 |
0 |
0 |
0 |
0.000 |
33 |
35 |
|
[MAN]D:506 |
6 |
1 |
290 |
cf |
[BMA]D:503 |
x,y,z |
1_555 |
4 |
1 |
291 |
46.0 |
2.1 |
0.268 |
0 |
0 |
0 |
0.000 |
34 |
36 |
|
[MAN]D:504 |
7 |
1 |
290 |
◊ |
[NAG]C:502 |
x,y,z |
1_555 |
7 |
1 |
359 |
45.4 |
0.4 |
0.066 |
0 |
0 |
0 |
0.000 |
35 |
37 |
|
[FUC]C:508 |
4 |
1 |
282 |
◊ |
[NAG]D:505 |
x,y,z |
1_555 |
6 |
1 |
355 |
42.9 |
1.3 |
0.127 |
0 |
0 |
0 |
0.000 |
36 |
38 |
|
[MAN]C:504 |
4 |
1 |
294 |
◊ |
[NAG]D:502 |
x,y,z |
1_555 |
4 |
1 |
364 |
41.3 |
0.6 |
0.151 |
0 |
0 |
0 |
0.000 |
37 |
39 |
|
[FUC]D:508 |
5 |
1 |
280 |
f |
[NAG]D:502 |
x,y,z |
1_555 |
4 |
1 |
364 |
39.6 |
1.6 |
0.199 |
0 |
0 |
0 |
0.000 |
38 |
40 |
|
[NAG]C:505 |
4 |
1 |
351 |
f |
C |
x,y,z |
1_555 |
6 |
4 |
11455 |
37.2 |
0.1 |
0.229 |
0 |
0 |
0 |
0.000 |
39 |
41 |
|
[FUC]C:508 |
4 |
1 |
282 |
f |
[NAG]C:502 |
x,y,z |
1_555 |
4 |
1 |
359 |
37.1 |
1.4 |
0.295 |
0 |
0 |
0 |
0.000 |
40 |
42 |
|
[MAN]D:506 |
4 |
1 |
290 |
f |
D |
x,y,z |
1_555 |
6 |
1 |
11822 |
34.1 |
0.8 |
0.325 |
0 |
0 |
0 |
0.000 |
41 |
43 |
|
[MAN]D:504 |
5 |
1 |
290 |
f |
D |
x,y,z |
1_555 |
3 |
1 |
11822 |
33.0 |
-0.3 |
0.113 |
0 |
0 |
0 |
0.000 |
42 |
44 |
|
[FUC]D:508 |
7 |
1 |
280 |
f |
D |
x,y,z |
1_555 |
5 |
2 |
11822 |
32.0 |
0.9 |
0.267 |
0 |
0 |
0 |
0.000 |
43 |
45 |
|
A |
4 |
1 |
10479 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
6 |
3 |
11822 |
31.1 |
0.0 |
0.662 |
0 |
0 |
0 |
0.000 |
44 |
46 |
|
[MAN]D:504 |
5 |
1 |
290 |
◊ |
[BMA]C:503 |
x,y,z |
1_555 |
4 |
1 |
289 |
29.3 |
0.2 |
0.125 |
0 |
0 |
0 |
0.000 |
45 |
47 |
|
[MAN]C:504 |
4 |
1 |
294 |
◊ |
[BMA]D:503 |
x,y,z |
1_555 |
3 |
1 |
291 |
28.6 |
-0.2 |
0.126 |
0 |
0 |
0 |
0.000 |
46 |
48 |
|
A |
8 |
6 |
10479 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
6 |
4 |
10479 |
28.5 |
0.2 |
0.727 |
0 |
0 |
0 |
0.000 |
47 |
49 |
|
[FUC]D:508 |
4 |
1 |
280 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
11822 |
28.2 |
0.4 |
0.208 |
0 |
0 |
0 |
0.000 |
48 |
50 |
|
A |
3 |
1 |
10479 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
10479 |
26.8 |
-0.6 |
0.177 |
0 |
0 |
0 |
0.000 |
49 |
51 |
|
[MAN]C:504 |
5 |
1 |
294 |
f |
C |
x,y,z |
1_555 |
4 |
1 |
11455 |
26.3 |
-0.2 |
0.179 |
0 |
0 |
0 |
0.000 |
50 |
52 |
|
[MAN]D:504 |
3 |
1 |
290 |
◊ |
[MAN]C:506 |
x,y,z |
1_555 |
4 |
1 |
293 |
24.7 |
0.6 |
0.213 |
0 |
0 |
0 |
0.000 |
51 |
53 |
|
[BMA]C:503 |
3 |
1 |
289 |
f |
[NAG]C:505 |
x,y,z |
1_555 |
3 |
1 |
351 |
23.3 |
0.8 |
0.222 |
0 |
0 |
0 |
0.000 |
52 |
54 |
|
B |
5 |
2 |
9864 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
2 |
9864 |
20.8 |
-0.4 |
0.347 |
0 |
0 |
0 |
0.000 |
53 |
55 |
|
[BMA]D:503 |
2 |
1 |
291 |
f |
[NAG]D:507 |
x,y,z |
1_555 |
4 |
1 |
361 |
18.9 |
0.9 |
0.230 |
0 |
0 |
0 |
0.000 |
54 |
56 |
|
A |
3 |
1 |
10479 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
1 |
11455 |
18.2 |
0.3 |
0.751 |
0 |
0 |
0 |
0.000 |
55 |
57 |
|
[BMA]D:503 |
3 |
1 |
291 |
f |
[NAG]D:505 |
x,y,z |
1_555 |
4 |
1 |
355 |
18.0 |
0.7 |
0.188 |
0 |
0 |
0 |
0.000 |
56 |
58 |
|
[MAN]C:504 |
3 |
1 |
294 |
f |
[NAG]C:502 |
x,y,z |
1_555 |
3 |
1 |
359 |
17.9 |
0.6 |
0.245 |
0 |
0 |
0 |
0.000 |
57 |
59 |
|
[MAN]D:504 |
3 |
1 |
290 |
f |
[NAG]D:502 |
x,y,z |
1_555 |
2 |
1 |
364 |
17.2 |
0.6 |
0.245 |
0 |
0 |
0 |
0.000 |
58 |
60 |
|
[BMA]C:503 |
2 |
1 |
289 |
f |
[NAG]C:507 |
x,y,z |
1_555 |
2 |
1 |
361 |
16.9 |
0.7 |
0.262 |
0 |
0 |
0 |
0.000 |
59 |
61 |
|
[BMA]D:503 |
3 |
1 |
291 |
◊ |
[BMA]C:503 |
x,y,z |
1_555 |
2 |
1 |
289 |
13.1 |
0.3 |
0.246 |
0 |
0 |
0 |
0.000 |
60 |
62 |
|
[FUC]C:508 |
4 |
1 |
282 |
f |
C |
x,y,z |
1_555 |
3 |
2 |
11455 |
12.6 |
0.4 |
0.313 |
0 |
0 |
0 |
0.000 |
61 |
63 |
|
[MAN]D:504 |
1 |
1 |
290 |
◊ |
[MAN]C:504 |
x,y,z |
1_555 |
1 |
1 |
294 |
10.9 |
0.2 |
0.182 |
0 |
0 |
0 |
0.000 |
62 |
64 |
|
[FUC]C:508 |
2 |
1 |
282 |
◊ |
[MAN]D:504 |
x,y,z |
1_555 |
3 |
1 |
290 |
8.2 |
0.4 |
0.274 |
0 |
0 |
0 |
0.000 |
63 |
65 |
|
[FUC]D:508 |
2 |
1 |
280 |
◊ |
[NAG]C:505 |
x,y,z |
1_555 |
1 |
1 |
351 |
8.0 |
0.4 |
0.346 |
0 |
0 |
0 |
0.000 |
64 |
66 |
|
[MAN]C:506 |
2 |
1 |
293 |
◊ |
[NAG]D:505 |
x,y,z |
1_555 |
1 |
1 |
355 |
6.8 |
0.2 |
0.275 |
0 |
0 |
0 |
0.000 |
65 |
67 |
|
[NAG]C:505 |
1 |
1 |
351 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
11822 |
6.7 |
0.2 |
0.473 |
0 |
0 |
0 |
0.000 |
66 |
68 |
|
A |
1 |
1 |
10479 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
11455 |
2.6 |
-0.1 |
0.412 |
0 |
0 |
0 |
0.000 |
67 |
69 |
|
B |
1 |
1 |
9864 |
◊ |
D |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
11822 |
2.3 |
0.0 |
0.700 |
0 |
0 |
0 |
0.000 |
68 |
70 |
|
[FUC]C:508 |
1 |
1 |
282 |
f |
[MAN]C:506 |
x,y,z |
1_555 |
1 |
1 |
293 |
1.7 |
0.0 |
0.191 |
0 |
0 |
0 |
0.000 |
69 |
71 |
|
[MAN]D:506 |
1 |
1 |
290 |
◊ |
[MAN]C:504 |
x,y,z |
1_555 |
1 |
1 |
294 |
0.8 |
0.0 |
0.182 |
0 |
0 |
0 |
0.000 |
70 |
72 |
|
[MAN]D:504 |
1 |
1 |
290 |
◊ |
[NAG]C:501 |
x,y,z |
1_555 |
1 |
1 |
354 |
0.5 |
0.0 |
0.161 |
0 |
0 |
0 |
0.000 |
|