| ## |
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 |
|
F |
150 |
33 |
6615 |
◊ |
E |
x,y,z |
1_555 |
161 |
50 |
15022 |
1476.0 |
-13.5 |
0.197 |
19 |
12 |
0 |
1.000 |
2 |
|
B |
143 |
33 |
6513 |
◊ |
A |
x,y,z |
1_555 |
160 |
50 |
15050 |
1458.2 |
-14.4 |
0.172 |
17 |
12 |
0 |
1.000 |
| Average: |
1467.1 |
-14.0 |
0.184 |
18 |
12 |
0 |
1.000 |
| 2 |
3 |
|
C |
64 |
9 |
1472 |
◊ |
A |
x,y,z |
1_555 |
113 |
36 |
15050 |
900.5 |
-12.3 |
0.480 |
8 |
4 |
0 |
1.000 |
| 3 |
4 |
|
G |
64 |
9 |
1415 |
◊ |
E |
x,y,z |
1_555 |
118 |
37 |
15022 |
892.1 |
-12.0 |
0.494 |
9 |
2 |
0 |
1.000 |
| 4 |
5 |
|
D |
62 |
16 |
10009 |
◊ |
A |
x,y,z |
1_555 |
68 |
17 |
15050 |
594.6 |
-0.2 |
0.724 |
9 |
9 |
0 |
0.023 |
6 |
|
H |
63 |
17 |
10031 |
◊ |
E |
x,y,z |
1_555 |
68 |
17 |
15022 |
579.4 |
-1.4 |
0.569 |
7 |
8 |
0 |
0.023 |
| Average: |
587.0 |
-0.8 |
0.646 |
8 |
9 |
0 |
0.023 |
| 5 |
7 |
|
D |
56 |
15 |
10009 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
60 |
18 |
15050 |
530.2 |
1.0 |
0.787 |
11 |
1 |
0 |
0.000 |
8 |
|
E |
56 |
16 |
15022 |
◊ |
H |
-x+1,y-1/2,-z+1 |
2_646 |
52 |
14 |
10031 |
474.9 |
-0.1 |
0.666 |
9 |
1 |
0 |
0.000 |
| Average: |
502.6 |
0.5 |
0.727 |
10 |
1 |
0 |
0.000 |
| 6 |
9 |
|
H |
51 |
17 |
10031 |
◊ |
F |
x,y,z |
1_555 |
56 |
16 |
6615 |
518.7 |
-2.8 |
0.448 |
9 |
0 |
0 |
0.027 |
10 |
|
D |
54 |
18 |
10009 |
◊ |
B |
x,y,z |
1_555 |
60 |
17 |
6513 |
497.1 |
-2.5 |
0.505 |
10 |
1 |
0 |
0.027 |
| Average: |
507.9 |
-2.7 |
0.477 |
10 |
1 |
0 |
0.027 |
| 7 |
11 |
|
E |
29 |
8 |
15022 |
◊ |
A |
x,y,z |
1_555 |
31 |
8 |
15050 |
284.1 |
-4.0 |
0.254 |
4 |
0 |
0 |
0.000 |
| 8 |
12 |
|
H |
21 |
7 |
10031 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
18 |
3 |
6615 |
192.1 |
-2.0 |
0.331 |
0 |
0 |
0 |
0.000 |
13 |
|
B |
16 |
3 |
6513 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
15 |
6 |
10009 |
160.9 |
-3.1 |
0.176 |
0 |
0 |
0 |
0.000 |
| Average: |
176.5 |
-2.5 |
0.253 |
0 |
0 |
0 |
0.000 |
| 9 |
14 |
|
H |
17 |
6 |
10031 |
x |
H |
-x+2,y-1/2,-z+1 |
2_746 |
21 |
7 |
10031 |
168.9 |
-0.3 |
0.623 |
2 |
0 |
0 |
0.000 |
| 10 |
15 |
|
[NAG]A:831 |
14 |
1 |
358 |
◊ |
A |
x,y,z |
1_555 |
21 |
7 |
15050 |
150.0 |
3.7 |
0.467 |
1 |
0 |
0 |
0.000 |
| 11 |
16 |
|
[NAG]E:831 |
11 |
1 |
362 |
f |
E |
x,y,z |
1_555 |
16 |
7 |
15022 |
128.8 |
3.3 |
0.482 |
1 |
0 |
0 |
0.000 |
| 12 |
17 |
|
F |
12 |
5 |
6615 |
◊ |
H |
x-1,y,z |
1_455 |
21 |
8 |
10031 |
110.0 |
2.0 |
0.852 |
3 |
4 |
0 |
0.000 |
| 13 |
18 |
|
[NAG]A:871 |
9 |
1 |
367 |
◊ |
A |
x,y,z |
1_555 |
15 |
5 |
15050 |
104.3 |
2.7 |
0.482 |
0 |
0 |
0 |
0.000 |
| 14 |
19 |
|
[BMA]A:813 |
9 |
1 |
303 |
◊ |
E |
x-1,y,z |
1_455 |
15 |
5 |
15022 |
97.1 |
1.0 |
0.239 |
1 |
0 |
0 |
0.000 |
| 15 |
20 |
|
[NAG]A:891 |
12 |
1 |
361 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
15050 |
96.3 |
2.3 |
0.280 |
1 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[NAG]E:891 |
11 |
1 |
360 |
◊ |
E |
x,y,z |
1_555 |
7 |
4 |
15022 |
87.7 |
2.0 |
0.292 |
0 |
0 |
0 |
0.000 |
| 17 |
22 |
|
[NAG]E:861 |
9 |
1 |
367 |
f |
E |
x,y,z |
1_555 |
13 |
5 |
15022 |
87.3 |
2.1 |
0.411 |
0 |
0 |
0 |
0.000 |
| 18 |
23 |
|
[NAG]E:871 |
8 |
1 |
365 |
◊ |
E |
x,y,z |
1_555 |
9 |
5 |
15022 |
86.9 |
2.1 |
0.368 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
[NAG]A:832 |
9 |
1 |
365 |
f |
[NAG]A:831 |
x,y,z |
1_555 |
6 |
1 |
358 |
78.1 |
1.5 |
0.110 |
2 |
0 |
0 |
0.000 |
| 20 |
25 |
|
[NAG]A:861 |
7 |
1 |
369 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
15050 |
74.3 |
2.0 |
0.490 |
1 |
0 |
0 |
0.000 |
| 21 |
26 |
|
[NAG]A:810 |
8 |
1 |
356 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
15050 |
72.9 |
1.3 |
0.310 |
0 |
0 |
0 |
0.000 |
| 22 |
27 |
|
[NAG]A:811 |
9 |
1 |
367 |
cf |
[NAG]A:810 |
x,y,z |
1_555 |
6 |
1 |
356 |
66.6 |
1.1 |
0.079 |
1 |
0 |
0 |
0.000 |
| 23 |
28 |
|
[NAG]E:832 |
7 |
1 |
363 |
cf |
[NAG]E:831 |
x,y,z |
1_555 |
7 |
1 |
362 |
66.0 |
0.8 |
0.073 |
0 |
0 |
0 |
0.000 |
| 24 |
29 |
|
[FUC]A:814 |
6 |
1 |
285 |
◊ |
[NAG]A:810 |
x,y,z |
1_555 |
8 |
1 |
356 |
63.9 |
2.2 |
0.146 |
0 |
0 |
0 |
0.000 |
| 25 |
30 |
|
[BMA]A:813 |
7 |
1 |
303 |
f |
[MAN]A:812 |
x,y,z |
1_555 |
7 |
1 |
298 |
61.8 |
2.5 |
0.220 |
0 |
0 |
0 |
0.000 |
| 26 |
31 |
|
[MAN]A:812 |
8 |
1 |
298 |
f |
[NAG]A:811 |
x,y,z |
1_555 |
6 |
1 |
367 |
59.1 |
0.8 |
0.096 |
1 |
0 |
0 |
0.000 |
| 27 |
32 |
|
[NAG]E:810 |
7 |
1 |
365 |
◊ |
E |
x,y,z |
1_555 |
6 |
2 |
15022 |
57.0 |
1.0 |
0.295 |
0 |
0 |
0 |
0.000 |
| 28 |
33 |
|
D |
7 |
3 |
10009 |
x |
D |
-x+1,y-1/2,-z |
2_645 |
6 |
2 |
10009 |
54.9 |
-0.0 |
0.605 |
0 |
0 |
0 |
0.000 |
| 29 |
34 |
|
[FUC]A:814 |
5 |
1 |
285 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
15050 |
54.4 |
-0.4 |
0.218 |
0 |
0 |
0 |
0.029 |
| 30 |
35 |
|
[NAG]A:871 |
9 |
1 |
367 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
1472 |
52.6 |
0.0 |
0.181 |
1 |
0 |
0 |
0.100 |
| 31 |
36 |
|
[NAG]A:811 |
7 |
1 |
367 |
◊ |
E |
x-1,y,z |
1_455 |
5 |
1 |
15022 |
50.1 |
0.3 |
0.230 |
0 |
0 |
0 |
0.000 |
| 32 |
37 |
|
[MAN]A:812 |
4 |
1 |
298 |
f |
F |
x,y,z |
1_555 |
5 |
2 |
6615 |
46.0 |
0.4 |
0.296 |
0 |
0 |
0 |
0.000 |
| 33 |
38 |
|
F |
3 |
1 |
6615 |
◊ |
E |
x-1,y,z |
1_455 |
4 |
1 |
15022 |
43.8 |
1.2 |
0.799 |
2 |
1 |
0 |
0.000 |
| 34 |
39 |
|
[NAG]A:891 |
3 |
1 |
361 |
f |
E |
x,y,z |
1_555 |
4 |
2 |
15022 |
43.2 |
0.4 |
0.322 |
0 |
0 |
0 |
0.000 |
| 35 |
40 |
|
[FUC]A:814 |
4 |
1 |
285 |
◊ |
[NAG]A:811 |
x,y,z |
1_555 |
6 |
1 |
367 |
43.0 |
1.9 |
0.275 |
0 |
0 |
0 |
0.000 |
| 36 |
41 |
|
[MAN]A:812 |
5 |
1 |
298 |
◊ |
E |
x-1,y,z |
1_455 |
6 |
1 |
15022 |
42.0 |
0.9 |
0.403 |
0 |
0 |
0 |
0.000 |
| 37 |
42 |
|
[FUC]A:814 |
5 |
1 |
285 |
◊ |
E |
x-1,y,z |
1_455 |
3 |
1 |
15022 |
33.1 |
-0.0 |
0.182 |
0 |
0 |
0 |
0.000 |
| 38 |
43 |
|
[BMA]A:813 |
3 |
1 |
303 |
f |
F |
x,y,z |
1_555 |
3 |
1 |
6615 |
32.0 |
0.6 |
0.448 |
0 |
0 |
0 |
0.000 |
| 39 |
44 |
|
[NAG]E:891 |
4 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
15050 |
26.2 |
-0.1 |
0.266 |
0 |
0 |
0 |
0.005 |
| 40 |
45 |
|
[BMA]A:813 |
3 |
1 |
303 |
f |
[NAG]A:811 |
x,y,z |
1_555 |
3 |
1 |
367 |
25.2 |
0.6 |
0.244 |
1 |
0 |
0 |
0.000 |
| 41 |
46 |
|
[NAG]E:871 |
2 |
1 |
365 |
f |
G |
x,y,z |
1_555 |
5 |
2 |
1415 |
14.4 |
0.1 |
0.395 |
0 |
0 |
0 |
0.000 |
| 42 |
47 |
|
D |
1 |
1 |
10009 |
x |
D |
-x,y-1/2,-z |
2_545 |
4 |
1 |
10009 |
10.9 |
0.2 |
0.725 |
0 |
0 |
0 |
0.000 |
48 |
|
H |
1 |
1 |
10031 |
x |
H |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
10031 |
7.6 |
-0.2 |
0.343 |
0 |
0 |
0 |
0.000 |
| Average: |
9.3 |
-0.0 |
0.534 |
0 |
0 |
0 |
0.000 |
| 43 |
49 |
|
[NAG]A:810 |
1 |
1 |
356 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
15022 |
9.3 |
0.2 |
0.406 |
0 |
0 |
0 |
0.000 |
| 44 |
50 |
|
[NAG]E:810 |
5 |
1 |
365 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
6513 |
9.0 |
0.2 |
0.233 |
0 |
0 |
0 |
0.000 |
| 45 |
51 |
|
[NAG]E:832 |
2 |
1 |
363 |
f |
E |
x,y,z |
1_555 |
2 |
2 |
15022 |
8.6 |
0.4 |
0.404 |
0 |
0 |
0 |
0.000 |
| 46 |
52 |
|
[NAG]A:811 |
2 |
1 |
367 |
f |
F |
x,y,z |
1_555 |
1 |
1 |
6615 |
7.6 |
-0.0 |
0.247 |
0 |
0 |
0 |
0.002 |
| 47 |
53 |
|
B |
3 |
2 |
6513 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
2 |
15050 |
5.3 |
-0.1 |
0.534 |
0 |
0 |
0 |
0.000 |
| 48 |
54 |
|
B |
1 |
1 |
6513 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
15022 |
4.0 |
0.1 |
0.643 |
0 |
0 |
0 |
0.000 |
| 49 |
55 |
|
[NAG]A:832 |
2 |
1 |
365 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
15050 |
0.7 |
0.0 |
0.385 |
0 |
0 |
0 |
0.000 |
| 50 |
56 |
|
[NAG]A:832 |
1 |
1 |
365 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
6513 |
0.6 |
0.0 |
0.270 |
0 |
0 |
0 |
0.000 |
|