## |
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 |
253 |
59 |
11468 |
◊ |
C |
x,y,z |
1_555 |
271 |
71 |
11449 |
2462.8 |
-21.5 |
0.410 |
42 |
15 |
0 |
1.000 |
2 |
|
B |
253 |
60 |
11328 |
◊ |
A |
x,y,z |
1_555 |
269 |
69 |
11497 |
2462.7 |
-21.4 |
0.432 |
43 |
15 |
0 |
1.000 |
Average: |
2462.8 |
-21.5 |
0.421 |
43 |
15 |
0 |
1.000 |
2 |
3 |
|
F |
219 |
63 |
13132 |
◊ |
E |
x,y,z |
1_555 |
232 |
59 |
12267 |
2021.1 |
-24.0 |
0.119 |
28 |
5 |
1 |
1.000 |
4 |
|
H |
213 |
63 |
13057 |
◊ |
G |
x,y,z |
1_555 |
234 |
58 |
12193 |
2019.4 |
-25.5 |
0.135 |
27 |
5 |
1 |
1.000 |
Average: |
2020.2 |
-24.8 |
0.127 |
28 |
5 |
1 |
1.000 |
3 |
5 |
|
E |
94 |
27 |
12267 |
◊ |
G |
x-1/2,-y+1/2,-z+1 |
4_456 |
91 |
27 |
12193 |
876.9 |
-1.1 |
0.728 |
10 |
0 |
0 |
0.000 |
4 |
6 |
|
I |
67 |
13 |
2013 |
◊ |
D |
x,y,z |
1_555 |
77 |
25 |
11468 |
595.2 |
-7.0 |
0.464 |
10 |
0 |
0 |
0.268 |
7 |
|
J |
64 |
13 |
2114 |
◊ |
B |
x,y,z |
1_555 |
79 |
25 |
11328 |
595.0 |
-5.5 |
0.608 |
10 |
0 |
0 |
0.268 |
Average: |
595.1 |
-6.3 |
0.536 |
10 |
0 |
0 |
0.268 |
5 |
8 |
|
J |
55 |
16 |
2114 |
◊ |
A |
x,y,z |
1_555 |
81 |
25 |
11497 |
593.8 |
-3.9 |
0.678 |
11 |
8 |
0 |
0.239 |
9 |
|
I |
51 |
14 |
2013 |
◊ |
C |
x,y,z |
1_555 |
75 |
24 |
11449 |
590.6 |
-3.8 |
0.656 |
11 |
8 |
0 |
0.239 |
Average: |
592.2 |
-3.9 |
0.667 |
11 |
8 |
0 |
0.239 |
6 |
10 |
|
F |
64 |
17 |
13132 |
◊ |
G |
-x+5/2,-y,z-1/2 |
2_754 |
55 |
14 |
12193 |
531.3 |
5.0 |
0.869 |
11 |
4 |
0 |
0.000 |
11 |
|
E |
54 |
14 |
12267 |
◊ |
H |
-x+5/2,-y,z-1/2 |
2_754 |
67 |
18 |
13057 |
530.3 |
5.4 |
0.876 |
11 |
4 |
0 |
0.000 |
Average: |
530.8 |
5.2 |
0.872 |
11 |
4 |
0 |
0.000 |
7 |
12 |
|
C |
38 |
13 |
11449 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
33 |
10 |
11497 |
332.6 |
-4.0 |
0.372 |
3 |
0 |
0 |
0.000 |
8 |
13 |
|
C |
32 |
10 |
11449 |
◊ |
F |
x-1/2,-y+1/2,-z |
4_455 |
37 |
16 |
13132 |
301.1 |
-4.1 |
0.335 |
0 |
0 |
0 |
0.000 |
9 |
14 |
|
E |
28 |
8 |
12267 |
◊ |
D |
x,y,z |
1_555 |
30 |
9 |
11468 |
242.2 |
-1.3 |
0.537 |
2 |
2 |
0 |
0.000 |
15 |
|
G |
25 |
9 |
12193 |
◊ |
B |
x,y,z |
1_555 |
27 |
9 |
11328 |
234.3 |
-1.2 |
0.571 |
1 |
2 |
0 |
0.000 |
Average: |
238.3 |
-1.2 |
0.554 |
2 |
2 |
0 |
0.000 |
10 |
16 |
|
H |
26 |
9 |
13057 |
◊ |
A |
x,y,z |
1_555 |
27 |
7 |
11497 |
238.3 |
-0.7 |
0.613 |
2 |
2 |
0 |
0.000 |
17 |
|
F |
24 |
8 |
13132 |
◊ |
C |
x,y,z |
1_555 |
26 |
7 |
11449 |
231.1 |
-0.6 |
0.633 |
2 |
2 |
0 |
0.000 |
Average: |
234.7 |
-0.6 |
0.623 |
2 |
2 |
0 |
0.000 |
11 |
18 |
|
J |
15 |
5 |
2114 |
◊ |
H |
x,y,z |
1_555 |
17 |
9 |
13057 |
175.4 |
-0.5 |
0.588 |
2 |
0 |
0 |
0.000 |
19 |
|
I |
14 |
4 |
2013 |
◊ |
F |
x,y,z |
1_555 |
18 |
9 |
13132 |
173.5 |
-1.1 |
0.517 |
3 |
0 |
0 |
0.000 |
Average: |
174.5 |
-0.8 |
0.553 |
3 |
0 |
0 |
0.000 |
12 |
20 |
|
E |
22 |
5 |
12267 |
◊ |
C |
x,y,z |
1_555 |
19 |
5 |
11449 |
174.4 |
-0.5 |
0.570 |
1 |
0 |
0 |
0.000 |
21 |
|
G |
21 |
5 |
12193 |
◊ |
A |
x,y,z |
1_555 |
19 |
5 |
11497 |
166.8 |
-0.6 |
0.550 |
1 |
0 |
0 |
0.000 |
Average: |
170.6 |
-0.6 |
0.560 |
1 |
0 |
0 |
0.000 |
13 |
22 |
|
F |
19 |
7 |
13132 |
◊ |
D |
x,y,z |
1_555 |
24 |
7 |
11468 |
164.1 |
-2.4 |
0.339 |
1 |
0 |
0 |
0.000 |
23 |
|
H |
17 |
6 |
13057 |
◊ |
B |
x,y,z |
1_555 |
21 |
6 |
11328 |
152.0 |
-2.5 |
0.299 |
1 |
0 |
0 |
0.000 |
Average: |
158.0 |
-2.4 |
0.319 |
1 |
0 |
0 |
0.000 |
14 |
24 |
|
[NAG]A:1000 |
10 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
23 |
7 |
11497 |
153.2 |
5.0 |
0.622 |
0 |
0 |
0 |
0.000 |
25 |
|
[NAG]C:1000 |
10 |
1 |
364 |
cf |
C |
x,y,z |
1_555 |
22 |
7 |
11449 |
152.4 |
4.9 |
0.612 |
0 |
0 |
0 |
0.000 |
Average: |
152.8 |
5.0 |
0.617 |
0 |
0 |
0 |
0.000 |
15 |
26 |
|
I |
16 |
6 |
2013 |
◊ |
E |
x,y,z |
1_555 |
18 |
4 |
12267 |
147.0 |
1.0 |
0.798 |
3 |
0 |
0 |
0.000 |
27 |
|
J |
18 |
7 |
2114 |
◊ |
G |
x,y,z |
1_555 |
17 |
5 |
12193 |
144.9 |
1.0 |
0.816 |
4 |
0 |
0 |
0.000 |
Average: |
146.0 |
1.0 |
0.807 |
4 |
0 |
0 |
0.000 |
16 |
28 |
|
E |
16 |
3 |
12267 |
◊ |
G |
-x+5/2,-y,z-1/2 |
2_754 |
16 |
3 |
12193 |
141.8 |
-2.6 |
0.243 |
2 |
0 |
0 |
0.000 |
17 |
29 |
|
E |
15 |
6 |
12267 |
◊ |
H |
x-1/2,-y+1/2,-z+1 |
4_456 |
13 |
4 |
13057 |
122.5 |
-0.7 |
0.473 |
0 |
0 |
0 |
0.000 |
30 |
|
F |
12 |
4 |
13132 |
◊ |
G |
x-1/2,-y+1/2,-z+1 |
4_456 |
13 |
5 |
12193 |
104.0 |
-0.3 |
0.480 |
0 |
0 |
0 |
0.000 |
Average: |
113.2 |
-0.5 |
0.476 |
0 |
0 |
0 |
0.000 |
18 |
31 |
|
[FUC]D:1003 |
9 |
1 |
281 |
f |
D |
x,y,z |
1_555 |
15 |
4 |
11468 |
93.1 |
2.9 |
0.472 |
1 |
0 |
0 |
0.000 |
32 |
|
[FUC]B:1003 |
9 |
1 |
281 |
f |
B |
x,y,z |
1_555 |
14 |
4 |
11328 |
92.4 |
2.9 |
0.416 |
1 |
0 |
0 |
0.000 |
Average: |
92.8 |
2.9 |
0.444 |
1 |
0 |
0 |
0.000 |
19 |
33 |
|
[NAG]D:1000 |
10 |
1 |
364 |
cf |
D |
x,y,z |
1_555 |
12 |
2 |
11468 |
88.5 |
1.9 |
0.289 |
0 |
0 |
0 |
0.000 |
34 |
|
[NAG]B:1000 |
9 |
1 |
364 |
cf |
B |
x,y,z |
1_555 |
11 |
2 |
11328 |
84.9 |
2.0 |
0.342 |
0 |
0 |
0 |
0.000 |
Average: |
86.7 |
1.9 |
0.316 |
0 |
0 |
0 |
0.000 |
20 |
35 |
|
F |
12 |
3 |
13132 |
◊ |
H |
-x+5/2,-y,z-1/2 |
2_754 |
11 |
3 |
13057 |
87.8 |
-1.5 |
0.371 |
0 |
0 |
0 |
0.000 |
21 |
36 |
|
[FUC]D:1002 |
6 |
1 |
281 |
◊ |
G |
x-3/2,-y+1/2,-z+1 |
4_356 |
9 |
2 |
12193 |
84.2 |
1.3 |
0.342 |
2 |
0 |
0 |
0.000 |
37 |
|
[FUC]B:1002 |
6 |
1 |
283 |
◊ |
E |
x-1/2,-y+1/2,-z+1 |
4_456 |
6 |
2 |
12267 |
65.6 |
0.2 |
0.181 |
1 |
0 |
0 |
0.000 |
Average: |
74.9 |
0.7 |
0.262 |
2 |
0 |
0 |
0.000 |
22 |
38 |
|
A |
9 |
2 |
11497 |
◊ |
H |
x-1,y,z |
1_455 |
9 |
4 |
13057 |
78.2 |
-0.3 |
0.577 |
1 |
0 |
0 |
0.000 |
23 |
39 |
|
A |
7 |
2 |
11497 |
◊ |
H |
x-1/2,-y+1/2,-z+1 |
4_456 |
9 |
4 |
13057 |
75.3 |
-0.8 |
0.447 |
0 |
0 |
0 |
0.000 |
24 |
40 |
|
[NAG]B:1001 |
8 |
1 |
362 |
cf |
[NAG]B:1000 |
x,y,z |
1_555 |
7 |
1 |
364 |
72.0 |
1.5 |
0.082 |
0 |
0 |
0 |
0.000 |
41 |
|
[NAG]D:1001 |
7 |
1 |
362 |
cf |
[NAG]D:1000 |
x,y,z |
1_555 |
7 |
1 |
364 |
66.7 |
1.5 |
0.118 |
0 |
0 |
0 |
0.000 |
Average: |
69.4 |
1.5 |
0.100 |
0 |
0 |
0 |
0.000 |
25 |
42 |
|
[FUC]B:1002 |
7 |
1 |
283 |
f |
[NAG]B:1001 |
x,y,z |
1_555 |
7 |
1 |
362 |
68.2 |
3.1 |
0.186 |
0 |
0 |
0 |
0.000 |
43 |
|
[FUC]D:1002 |
7 |
1 |
281 |
f |
[NAG]D:1001 |
x,y,z |
1_555 |
7 |
1 |
362 |
62.2 |
3.0 |
0.181 |
0 |
0 |
0 |
0.000 |
Average: |
65.2 |
3.0 |
0.183 |
0 |
0 |
0 |
0.000 |
26 |
44 |
|
[FUC]D:1002 |
7 |
1 |
281 |
cf |
[NAG]D:1000 |
x,y,z |
1_555 |
9 |
1 |
364 |
67.9 |
2.3 |
0.093 |
0 |
0 |
0 |
0.000 |
45 |
|
[FUC]B:1002 |
7 |
1 |
283 |
cf |
[NAG]B:1000 |
x,y,z |
1_555 |
8 |
1 |
364 |
66.6 |
2.3 |
0.110 |
0 |
0 |
0 |
0.000 |
Average: |
67.3 |
2.3 |
0.101 |
0 |
0 |
0 |
0.000 |
27 |
46 |
|
[FUC]B:1003 |
6 |
1 |
281 |
cf |
[NAG]B:1000 |
x,y,z |
1_555 |
5 |
1 |
364 |
62.4 |
2.5 |
0.231 |
0 |
0 |
0 |
0.000 |
47 |
|
[FUC]D:1003 |
6 |
1 |
281 |
cf |
[NAG]D:1000 |
x,y,z |
1_555 |
5 |
1 |
364 |
60.8 |
2.6 |
0.284 |
0 |
0 |
0 |
0.000 |
Average: |
61.6 |
2.5 |
0.258 |
0 |
0 |
0 |
0.000 |
28 |
48 |
|
[NAG]D:1001 |
6 |
1 |
362 |
◊ |
G |
x-3/2,-y+1/2,-z+1 |
4_356 |
8 |
4 |
12193 |
57.2 |
1.6 |
0.410 |
0 |
0 |
0 |
0.000 |
49 |
|
[NAG]B:1001 |
5 |
1 |
362 |
◊ |
E |
x-1/2,-y+1/2,-z+1 |
4_456 |
5 |
2 |
12267 |
33.6 |
1.0 |
0.385 |
0 |
0 |
0 |
0.000 |
Average: |
45.4 |
1.3 |
0.397 |
0 |
0 |
0 |
0.000 |
29 |
50 |
|
D |
5 |
3 |
11468 |
◊ |
A |
-x+3/2,-y+1,z-1/2 |
2_664 |
2 |
1 |
11497 |
49.6 |
1.3 |
0.867 |
2 |
3 |
0 |
0.000 |
30 |
51 |
|
[FUC]B:1002 |
5 |
1 |
283 |
◊ |
H |
x-1,y,z |
1_455 |
2 |
2 |
13057 |
42.5 |
0.0 |
0.100 |
0 |
0 |
0 |
0.000 |
52 |
|
[FUC]D:1002 |
3 |
1 |
281 |
◊ |
F |
x-1,y,z |
1_455 |
2 |
2 |
13132 |
23.8 |
0.0 |
0.237 |
0 |
0 |
0 |
0.000 |
Average: |
33.2 |
0.0 |
0.169 |
0 |
0 |
0 |
0.000 |
31 |
53 |
|
[NAG]D:1000 |
5 |
1 |
364 |
◊ |
G |
x-3/2,-y+1/2,-z+1 |
4_356 |
4 |
1 |
12193 |
39.7 |
1.2 |
0.423 |
0 |
0 |
0 |
0.000 |
54 |
|
[NAG]B:1000 |
1 |
1 |
364 |
◊ |
E |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
12267 |
2.7 |
0.0 |
0.237 |
0 |
0 |
0 |
0.000 |
Average: |
21.2 |
0.6 |
0.330 |
0 |
0 |
0 |
0.000 |
32 |
55 |
|
[FUC]B:1003 |
3 |
1 |
281 |
f |
[NAG]B:1001 |
x,y,z |
1_555 |
4 |
1 |
362 |
32.6 |
2.0 |
0.308 |
0 |
0 |
0 |
0.000 |
56 |
|
[FUC]D:1003 |
4 |
1 |
281 |
f |
[NAG]D:1001 |
x,y,z |
1_555 |
4 |
1 |
362 |
32.2 |
2.0 |
0.305 |
0 |
0 |
0 |
0.000 |
Average: |
32.4 |
2.0 |
0.306 |
0 |
0 |
0 |
0.000 |
33 |
57 |
|
B |
3 |
2 |
11328 |
◊ |
H |
x-1,y,z |
1_455 |
3 |
1 |
13057 |
29.7 |
1.0 |
0.881 |
1 |
1 |
0 |
0.000 |
34 |
58 |
|
[NAG]B:1000 |
4 |
1 |
364 |
◊ |
H |
x-1,y,z |
1_455 |
5 |
2 |
13057 |
27.5 |
0.3 |
0.280 |
0 |
0 |
0 |
0.000 |
35 |
59 |
|
D |
2 |
2 |
11468 |
◊ |
F |
x-1,y,z |
1_455 |
4 |
1 |
13132 |
22.1 |
0.3 |
0.712 |
0 |
0 |
0 |
0.000 |
36 |
60 |
|
C |
2 |
1 |
11449 |
◊ |
F |
x-1,y,z |
1_455 |
2 |
1 |
13132 |
14.1 |
0.2 |
0.727 |
0 |
0 |
0 |
0.000 |
37 |
61 |
|
[NAG]B:1001 |
2 |
1 |
362 |
◊ |
G |
x-1,y,z |
1_455 |
1 |
1 |
12193 |
9.2 |
-0.0 |
0.226 |
0 |
0 |
0 |
0.000 |
38 |
62 |
|
[FUC]D:1002 |
1 |
1 |
281 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
11468 |
4.3 |
0.2 |
0.389 |
0 |
0 |
0 |
0.000 |
63 |
|
[FUC]B:1002 |
1 |
1 |
283 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
11328 |
4.1 |
0.2 |
0.389 |
0 |
0 |
0 |
0.000 |
Average: |
4.2 |
0.2 |
0.389 |
0 |
0 |
0 |
0.000 |
39 |
64 |
|
[FUC]D:1002 |
1 |
1 |
281 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
12267 |
4.1 |
0.1 |
0.383 |
0 |
0 |
0 |
0.000 |
65 |
|
[FUC]B:1002 |
1 |
1 |
283 |
◊ |
G |
x-1,y,z |
1_455 |
1 |
1 |
12193 |
3.3 |
-0.0 |
0.282 |
0 |
0 |
0 |
0.000 |
Average: |
3.7 |
0.0 |
0.333 |
0 |
0 |
0 |
0.000 |
40 |
66 |
|
D |
1 |
1 |
11468 |
x |
D |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
11468 |
4.0 |
-0.1 |
0.395 |
0 |
0 |
0 |
0.000 |
41 |
67 |
|
D |
3 |
1 |
11468 |
◊ |
G |
x-3/2,-y+1/2,-z+1 |
4_356 |
1 |
1 |
12193 |
3.8 |
0.1 |
0.703 |
0 |
0 |
0 |
0.000 |
42 |
68 |
|
[NAG]D:1001 |
1 |
1 |
362 |
f |
D |
x,y,z |
1_555 |
1 |
1 |
11468 |
1.4 |
0.0 |
0.276 |
0 |
0 |
0 |
0.000 |
69 |
|
[NAG]B:1001 |
1 |
1 |
362 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
11328 |
1.3 |
0.0 |
0.281 |
0 |
0 |
0 |
0.000 |
Average: |
1.4 |
0.0 |
0.279 |
0 |
0 |
0 |
0.000 |
43 |
70 |
|
B |
1 |
1 |
11328 |
◊ |
H |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
13057 |
1.0 |
-0.0 |
0.537 |
0 |
0 |
0 |
0.000 |
|