## |
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 |
215 |
58 |
11510 |
◊ |
A |
x,y,z |
1_555 |
194 |
55 |
11506 |
1894.0 |
-29.8 |
0.025 |
18 |
1 |
1 |
1.000 |
2 |
|
E |
202 |
55 |
11290 |
◊ |
D |
x,y,z |
1_555 |
192 |
56 |
11486 |
1831.5 |
-26.1 |
0.046 |
14 |
2 |
0 |
1.000 |
Average: |
1862.7 |
-27.9 |
0.036 |
16 |
2 |
1 |
1.000 |
2 |
3 |
|
A |
121 |
41 |
11506 |
◊ |
A |
-x-1,y,-z-1 |
2_454 |
122 |
41 |
11506 |
1111.3 |
-3.7 |
0.793 |
16 |
4 |
0 |
0.100 |
3 |
4 |
|
D |
103 |
39 |
11486 |
◊ |
D |
-x,y,-z |
2_555 |
101 |
39 |
11486 |
961.2 |
-2.3 |
0.815 |
20 |
2 |
0 |
0.100 |
4 |
5 |
|
F |
56 |
19 |
7156 |
◊ |
D |
x,y,z |
1_555 |
70 |
20 |
11486 |
556.0 |
-3.5 |
0.476 |
11 |
1 |
0 |
0.558 |
5 |
6 |
|
C |
53 |
18 |
7254 |
◊ |
A |
x,y,z |
1_555 |
70 |
20 |
11506 |
545.4 |
-3.6 |
0.447 |
10 |
2 |
0 |
0.374 |
6 |
7 |
|
D |
64 |
22 |
11486 |
◊ |
A |
x,y,z |
1_555 |
60 |
18 |
11506 |
543.0 |
-5.9 |
0.419 |
2 |
0 |
0 |
0.008 |
7 |
8 |
|
F |
42 |
14 |
7156 |
◊ |
E |
x,y,z |
1_555 |
43 |
11 |
11290 |
398.3 |
-3.3 |
0.314 |
2 |
1 |
0 |
0.286 |
8 |
9 |
|
C |
44 |
14 |
7254 |
◊ |
B |
x,y,z |
1_555 |
41 |
12 |
11510 |
375.6 |
-2.9 |
0.354 |
1 |
0 |
0 |
0.151 |
9 |
10 |
|
C |
37 |
13 |
7254 |
◊ |
F |
x-1,y,z |
1_455 |
35 |
13 |
7156 |
329.7 |
-5.5 |
0.141 |
6 |
0 |
0 |
0.299 |
10 |
11 |
|
E |
30 |
8 |
11290 |
◊ |
B |
x,y,z |
1_555 |
32 |
9 |
11510 |
304.5 |
-4.7 |
0.155 |
1 |
0 |
0 |
0.006 |
11 |
12 |
|
B |
30 |
10 |
11510 |
◊ |
D |
x,y,z |
1_555 |
30 |
11 |
11486 |
260.4 |
0.7 |
0.757 |
2 |
1 |
0 |
0.000 |
12 |
13 |
|
F |
22 |
10 |
7156 |
◊ |
D |
-x,y-1,-z |
2_545 |
22 |
6 |
11486 |
190.5 |
-2.2 |
0.372 |
1 |
0 |
0 |
0.344 |
13 |
14 |
|
[NAG]F:301 |
12 |
1 |
341 |
cf |
F |
x,y,z |
1_555 |
23 |
8 |
7156 |
161.8 |
4.7 |
0.250 |
1 |
0 |
0 |
0.000 |
15 |
|
[NAG]C:301 |
12 |
1 |
341 |
cf |
C |
x,y,z |
1_555 |
21 |
8 |
7254 |
156.7 |
4.5 |
0.227 |
1 |
0 |
0 |
0.000 |
Average: |
159.2 |
4.6 |
0.239 |
1 |
0 |
0 |
0.000 |
14 |
16 |
|
C |
15 |
5 |
7254 |
◊ |
A |
-x-1,y-1,-z-1 |
2_444 |
16 |
5 |
11506 |
149.6 |
-2.8 |
0.225 |
1 |
0 |
0 |
0.221 |
15 |
17 |
|
B |
11 |
5 |
11510 |
◊ |
A |
x,y-1,z |
1_545 |
21 |
8 |
11506 |
137.4 |
3.2 |
0.921 |
4 |
0 |
0 |
0.000 |
16 |
18 |
|
F |
14 |
4 |
7156 |
◊ |
E |
-x,y-1,-z |
2_545 |
15 |
5 |
11290 |
131.7 |
0.5 |
0.657 |
2 |
1 |
0 |
0.065 |
17 |
19 |
|
[NAG]C:306 |
12 |
1 |
365 |
cf |
C |
x,y,z |
1_555 |
19 |
6 |
7254 |
131.0 |
4.4 |
0.413 |
0 |
0 |
0 |
0.000 |
20 |
|
[NAG]F:306 |
12 |
1 |
363 |
cf |
F |
x,y,z |
1_555 |
18 |
6 |
7156 |
123.2 |
4.0 |
0.388 |
0 |
0 |
0 |
0.000 |
Average: |
127.1 |
4.2 |
0.401 |
0 |
0 |
0 |
0.000 |
18 |
21 |
|
[FUC]C:303 |
10 |
1 |
290 |
f |
C |
x,y,z |
1_555 |
22 |
7 |
7254 |
122.5 |
2.3 |
0.446 |
1 |
0 |
0 |
0.000 |
19 |
22 |
|
[FUC]F:303 |
10 |
1 |
289 |
f |
F |
x,y,z |
1_555 |
21 |
7 |
7156 |
121.8 |
2.2 |
0.427 |
1 |
0 |
0 |
0.000 |
20 |
23 |
|
[NAG]C:307 |
12 |
1 |
365 |
cf |
C |
x,y,z |
1_555 |
14 |
4 |
7254 |
119.6 |
4.0 |
0.388 |
0 |
0 |
0 |
0.000 |
21 |
24 |
|
[NAG]F:302 |
10 |
1 |
361 |
f |
F |
x,y,z |
1_555 |
16 |
7 |
7156 |
110.6 |
3.0 |
0.233 |
0 |
0 |
0 |
0.000 |
22 |
25 |
|
[NAG]C:302 |
9 |
1 |
360 |
f |
C |
x,y,z |
1_555 |
17 |
7 |
7254 |
106.9 |
2.9 |
0.266 |
0 |
0 |
0 |
0.000 |
23 |
26 |
|
[NAG]F:307 |
12 |
1 |
364 |
cf |
F |
x,y,z |
1_555 |
14 |
5 |
7156 |
106.5 |
2.8 |
0.286 |
1 |
0 |
0 |
0.000 |
24 |
27 |
|
E |
9 |
5 |
11290 |
◊ |
D |
x,y-1,z |
1_545 |
16 |
8 |
11486 |
92.6 |
2.6 |
0.866 |
4 |
0 |
0 |
0.000 |
25 |
28 |
|
[MAN]F:305 |
6 |
1 |
306 |
◊ |
D |
x,y,z |
1_555 |
12 |
6 |
11486 |
72.5 |
1.9 |
0.559 |
1 |
0 |
0 |
0.000 |
26 |
29 |
|
[NAG]C:302 |
10 |
1 |
360 |
cf |
[NAG]C:301 |
x,y,z |
1_555 |
5 |
1 |
341 |
69.9 |
2.9 |
0.020 |
0 |
0 |
0 |
0.000 |
30 |
|
[NAG]F:302 |
9 |
1 |
361 |
cf |
[NAG]F:301 |
x,y,z |
1_555 |
5 |
1 |
341 |
69.4 |
3.0 |
0.031 |
1 |
0 |
0 |
0.000 |
Average: |
69.7 |
2.9 |
0.025 |
1 |
0 |
0 |
0.000 |
27 |
31 |
|
[NAG]C:306 |
5 |
1 |
365 |
◊ |
F |
x-1,y,z |
1_455 |
8 |
5 |
7156 |
69.3 |
2.0 |
0.498 |
1 |
0 |
0 |
0.000 |
32 |
|
C |
10 |
5 |
7254 |
◊ |
[NAG]F:306 |
x-1,y,z |
1_455 |
7 |
1 |
363 |
69.1 |
1.9 |
0.382 |
1 |
0 |
0 |
0.000 |
Average: |
69.2 |
2.0 |
0.440 |
1 |
0 |
0 |
0.000 |
28 |
33 |
|
[NAG]F:307 |
9 |
1 |
364 |
◊ |
E |
-x,y-1,-z |
2_545 |
7 |
3 |
11290 |
68.9 |
1.2 |
0.247 |
0 |
0 |
0 |
0.000 |
34 |
|
[NAG]C:307 |
8 |
1 |
365 |
◊ |
B |
-x-1,y-1,-z-1 |
2_444 |
8 |
4 |
11510 |
65.0 |
1.7 |
0.363 |
0 |
0 |
0 |
0.000 |
Average: |
67.0 |
1.4 |
0.305 |
0 |
0 |
0 |
0.000 |
29 |
35 |
|
[FUC]C:303 |
9 |
1 |
290 |
◊ |
A |
x,y,z |
1_555 |
13 |
7 |
11506 |
64.1 |
0.2 |
0.159 |
1 |
0 |
0 |
0.009 |
30 |
36 |
|
[FUC]F:303 |
7 |
1 |
289 |
◊ |
D |
x,y,z |
1_555 |
12 |
6 |
11486 |
63.4 |
0.3 |
0.221 |
1 |
0 |
0 |
0.007 |
31 |
37 |
|
[BMA]C:304 |
8 |
1 |
291 |
cf |
[NAG]C:302 |
x,y,z |
1_555 |
5 |
1 |
360 |
63.1 |
2.5 |
0.112 |
1 |
0 |
0 |
0.000 |
38 |
|
[BMA]F:304 |
7 |
1 |
294 |
cf |
[NAG]F:302 |
x,y,z |
1_555 |
5 |
1 |
361 |
61.1 |
2.6 |
0.150 |
1 |
0 |
0 |
0.000 |
Average: |
62.1 |
2.5 |
0.131 |
1 |
0 |
0 |
0.000 |
32 |
39 |
|
[NAG]C:307 |
6 |
1 |
365 |
◊ |
A |
-x-1,y-1,-z-1 |
2_444 |
7 |
3 |
11506 |
59.2 |
0.4 |
0.273 |
1 |
0 |
0 |
0.006 |
33 |
40 |
|
[MAN]F:305 |
8 |
1 |
306 |
cf |
[BMA]F:304 |
x,y,z |
1_555 |
5 |
1 |
294 |
59.1 |
2.4 |
0.185 |
0 |
0 |
0 |
0.000 |
34 |
41 |
|
[MAN]C:305 |
6 |
1 |
303 |
cf |
[BMA]C:304 |
x,y,z |
1_555 |
5 |
1 |
291 |
56.0 |
2.2 |
0.237 |
0 |
0 |
0 |
0.000 |
35 |
42 |
|
[MAN]C:305 |
7 |
1 |
303 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
11506 |
54.1 |
0.8 |
0.314 |
1 |
0 |
0 |
0.000 |
36 |
43 |
|
[FUC]C:303 |
7 |
1 |
290 |
cf |
[NAG]C:301 |
x,y,z |
1_555 |
3 |
1 |
341 |
45.4 |
2.0 |
0.205 |
0 |
0 |
0 |
0.000 |
44 |
|
[FUC]F:303 |
7 |
1 |
289 |
cf |
[NAG]F:301 |
x,y,z |
1_555 |
3 |
1 |
341 |
45.2 |
1.9 |
0.205 |
0 |
0 |
0 |
0.000 |
Average: |
45.3 |
2.0 |
0.205 |
0 |
0 |
0 |
0.000 |
37 |
45 |
|
[NAG]C:302 |
6 |
1 |
360 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
11506 |
45.1 |
1.5 |
0.225 |
0 |
0 |
0 |
0.000 |
38 |
46 |
|
[NAG]F:302 |
6 |
1 |
361 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
11486 |
45.0 |
1.3 |
0.211 |
0 |
0 |
0 |
0.000 |
39 |
47 |
|
[FUC]C:303 |
5 |
1 |
290 |
f |
[NAG]C:302 |
x,y,z |
1_555 |
7 |
1 |
360 |
44.3 |
2.0 |
0.079 |
0 |
0 |
0 |
0.000 |
48 |
|
[FUC]F:303 |
5 |
1 |
289 |
f |
[NAG]F:302 |
x,y,z |
1_555 |
7 |
1 |
361 |
43.5 |
1.9 |
0.084 |
0 |
0 |
0 |
0.000 |
Average: |
43.9 |
2.0 |
0.081 |
0 |
0 |
0 |
0.000 |
40 |
49 |
|
B |
8 |
3 |
11510 |
◊ |
B |
-x-1,y,-z-1 |
2_454 |
7 |
3 |
11510 |
44.0 |
0.2 |
0.676 |
0 |
0 |
0 |
0.000 |
50 |
|
E |
3 |
3 |
11290 |
◊ |
E |
-x,y,-z |
2_555 |
3 |
3 |
11290 |
4.6 |
0.0 |
0.622 |
0 |
0 |
0 |
0.000 |
Average: |
24.3 |
0.1 |
0.649 |
0 |
0 |
0 |
0.000 |
41 |
51 |
|
C |
9 |
3 |
7254 |
◊ |
A |
x,y-1,z |
1_545 |
6 |
3 |
11506 |
43.1 |
0.4 |
0.687 |
0 |
0 |
0 |
0.000 |
42 |
52 |
|
[NAG]F:301 |
4 |
1 |
341 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
11486 |
43.0 |
0.9 |
0.273 |
1 |
0 |
0 |
0.000 |
53 |
|
[NAG]C:301 |
5 |
1 |
341 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
11506 |
42.3 |
0.8 |
0.230 |
1 |
0 |
0 |
0.000 |
Average: |
42.7 |
0.8 |
0.252 |
1 |
0 |
0 |
0.000 |
43 |
54 |
|
F |
4 |
2 |
7156 |
◊ |
E |
-x,y,-z |
2_555 |
4 |
2 |
11290 |
41.6 |
-0.3 |
0.475 |
1 |
0 |
0 |
0.000 |
44 |
55 |
|
[BMA]C:304 |
4 |
1 |
291 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
11506 |
38.7 |
0.8 |
0.370 |
1 |
0 |
0 |
0.000 |
45 |
56 |
|
[BMA]F:304 |
4 |
1 |
294 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
11486 |
37.8 |
0.8 |
0.356 |
1 |
0 |
0 |
0.000 |
46 |
57 |
|
F |
2 |
2 |
7156 |
◊ |
D |
x,y-1,z |
1_545 |
2 |
1 |
11486 |
13.4 |
-0.1 |
0.498 |
0 |
0 |
0 |
0.000 |
47 |
58 |
|
E |
2 |
1 |
11290 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
11506 |
13.0 |
-0.2 |
0.451 |
0 |
0 |
0 |
0.000 |
48 |
59 |
|
[MAN]F:305 |
2 |
1 |
306 |
f |
[NAG]F:302 |
x,y,z |
1_555 |
2 |
1 |
361 |
10.5 |
0.5 |
0.206 |
0 |
0 |
0 |
0.000 |
49 |
60 |
|
E |
1 |
1 |
11290 |
◊ |
D |
-x,y,-z |
2_555 |
3 |
1 |
11486 |
10.2 |
0.1 |
0.688 |
0 |
0 |
0 |
0.000 |
50 |
61 |
|
C |
1 |
1 |
7254 |
◊ |
B |
-x-1,y-1,-z-1 |
2_444 |
2 |
2 |
11510 |
9.4 |
0.2 |
0.743 |
0 |
0 |
0 |
0.000 |
51 |
62 |
|
[MAN]C:305 |
1 |
1 |
303 |
f |
[NAG]C:302 |
x,y,z |
1_555 |
1 |
1 |
360 |
9.3 |
0.4 |
0.289 |
0 |
0 |
0 |
0.000 |
52 |
63 |
|
F |
2 |
1 |
7156 |
◊ |
B |
x,y-1,z |
1_545 |
2 |
1 |
11510 |
7.7 |
0.2 |
0.705 |
0 |
0 |
0 |
0.000 |
53 |
64 |
|
[BMA]F:304 |
1 |
1 |
294 |
f |
[FUC]F:303 |
x,y,z |
1_555 |
1 |
1 |
289 |
4.3 |
0.1 |
0.182 |
0 |
0 |
0 |
0.000 |
54 |
65 |
|
[BMA]C:304 |
1 |
1 |
291 |
f |
[FUC]C:303 |
x,y,z |
1_555 |
1 |
1 |
290 |
3.4 |
0.1 |
0.182 |
0 |
0 |
0 |
0.000 |
55 |
66 |
|
[BMA]C:304 |
1 |
1 |
291 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
7254 |
2.8 |
0.1 |
0.369 |
0 |
0 |
0 |
0.000 |
|