| ## |
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 |
243 |
57 |
11068 |
◊ |
A |
x,y,z |
1_555 |
270 |
68 |
11289 |
2426.0 |
-21.8 |
0.454 |
46 |
10 |
0 |
1.000 |
2 |
|
D |
243 |
57 |
11194 |
◊ |
C |
x,y,z |
1_555 |
259 |
68 |
11242 |
2423.1 |
-21.1 |
0.503 |
48 |
14 |
0 |
1.000 |
| Average: |
2424.5 |
-21.4 |
0.478 |
47 |
12 |
0 |
1.000 |
| 2 |
3 |
|
F |
225 |
65 |
12970 |
◊ |
E |
x,y,z |
1_555 |
234 |
60 |
12279 |
2016.8 |
-27.6 |
0.056 |
28 |
6 |
1 |
1.000 |
4 |
|
H |
217 |
62 |
12793 |
◊ |
G |
x,y,z |
1_555 |
231 |
59 |
12187 |
1996.5 |
-24.9 |
0.099 |
28 |
6 |
1 |
1.000 |
| Average: |
2006.7 |
-26.2 |
0.078 |
28 |
6 |
1 |
1.000 |
| 3 |
5 |
|
J |
69 |
13 |
1836 |
◊ |
B |
x,y,z |
1_555 |
79 |
25 |
11068 |
599.1 |
-5.5 |
0.567 |
11 |
0 |
0 |
0.231 |
6 |
|
I |
68 |
13 |
1839 |
◊ |
D |
x,y,z |
1_555 |
79 |
25 |
11194 |
596.0 |
-5.5 |
0.563 |
10 |
0 |
0 |
0.231 |
| Average: |
597.5 |
-5.5 |
0.565 |
11 |
0 |
0 |
0.231 |
| 4 |
7 |
|
G |
62 |
17 |
12187 |
◊ |
F |
x,y-1,z |
1_545 |
56 |
15 |
12970 |
522.4 |
0.1 |
0.757 |
8 |
0 |
0 |
0.000 |
8 |
|
H |
60 |
16 |
12793 |
◊ |
E |
x-1,y-1,z |
1_445 |
61 |
17 |
12279 |
516.3 |
0.0 |
0.742 |
10 |
2 |
0 |
0.000 |
| Average: |
519.3 |
0.1 |
0.750 |
9 |
1 |
0 |
0.000 |
| 5 |
9 |
|
I |
49 |
13 |
1839 |
◊ |
C |
x,y,z |
1_555 |
65 |
22 |
11242 |
518.2 |
-4.3 |
0.506 |
10 |
8 |
0 |
0.219 |
10 |
|
J |
49 |
13 |
1836 |
◊ |
A |
x,y,z |
1_555 |
65 |
21 |
11289 |
508.8 |
-4.2 |
0.492 |
10 |
7 |
0 |
0.219 |
| Average: |
513.5 |
-4.3 |
0.499 |
10 |
8 |
0 |
0.219 |
| 6 |
11 |
|
E |
49 |
17 |
12279 |
◊ |
A |
x,y,z |
1_555 |
41 |
7 |
11289 |
449.4 |
0.9 |
0.729 |
8 |
6 |
0 |
0.000 |
| 7 |
12 |
|
F |
39 |
10 |
12970 |
◊ |
E |
x-1,y,z |
1_455 |
46 |
16 |
12279 |
368.8 |
0.4 |
0.751 |
5 |
1 |
0 |
0.000 |
13 |
|
H |
40 |
11 |
12793 |
◊ |
G |
x-1,y,z |
1_455 |
45 |
14 |
12187 |
366.9 |
0.0 |
0.730 |
4 |
2 |
0 |
0.000 |
| Average: |
367.9 |
0.2 |
0.741 |
5 |
2 |
0 |
0.000 |
| 8 |
14 |
|
F |
24 |
8 |
12970 |
◊ |
C |
x,y,z |
1_555 |
26 |
6 |
11242 |
244.3 |
-1.6 |
0.450 |
1 |
0 |
0 |
0.000 |
15 |
|
H |
29 |
8 |
12793 |
◊ |
A |
x,y,z |
1_555 |
25 |
6 |
11289 |
242.3 |
-1.3 |
0.442 |
0 |
0 |
0 |
0.000 |
| Average: |
243.3 |
-1.5 |
0.446 |
1 |
0 |
0 |
0.000 |
| 9 |
16 |
|
G |
35 |
9 |
12187 |
◊ |
C |
x,y,z |
1_555 |
21 |
4 |
11242 |
234.4 |
2.1 |
0.663 |
4 |
3 |
0 |
0.000 |
| 10 |
17 |
|
E |
21 |
9 |
12279 |
◊ |
D |
x,y,z |
1_555 |
27 |
7 |
11194 |
222.5 |
-2.9 |
0.345 |
0 |
0 |
0 |
0.000 |
18 |
|
G |
22 |
9 |
12187 |
◊ |
B |
x,y,z |
1_555 |
28 |
8 |
11068 |
218.5 |
-2.9 |
0.372 |
0 |
0 |
0 |
0.000 |
| Average: |
220.5 |
-2.9 |
0.358 |
0 |
0 |
0 |
0.000 |
| 11 |
19 |
|
I |
20 |
6 |
1839 |
◊ |
F |
x,y,z |
1_555 |
25 |
10 |
12970 |
183.3 |
0.2 |
0.717 |
4 |
0 |
0 |
0.000 |
20 |
|
J |
21 |
6 |
1836 |
◊ |
H |
x,y,z |
1_555 |
23 |
10 |
12793 |
182.0 |
0.3 |
0.721 |
4 |
0 |
0 |
0.000 |
| Average: |
182.6 |
0.3 |
0.719 |
4 |
0 |
0 |
0.000 |
| 12 |
21 |
|
H |
21 |
6 |
12793 |
◊ |
B |
x,y,z |
1_555 |
18 |
6 |
11068 |
170.5 |
-0.3 |
0.677 |
2 |
3 |
0 |
0.000 |
22 |
|
F |
20 |
6 |
12970 |
◊ |
D |
x,y,z |
1_555 |
17 |
6 |
11194 |
168.5 |
-0.2 |
0.672 |
2 |
3 |
0 |
0.000 |
| Average: |
169.5 |
-0.2 |
0.674 |
2 |
3 |
0 |
0.000 |
| 13 |
23 |
|
H |
21 |
7 |
12793 |
◊ |
F |
x-1,y-1,z |
1_445 |
14 |
6 |
12970 |
154.9 |
-1.7 |
0.351 |
0 |
1 |
0 |
0.000 |
24 |
|
H |
12 |
5 |
12793 |
◊ |
F |
x,y-1,z |
1_545 |
12 |
5 |
12970 |
95.3 |
-1.0 |
0.397 |
0 |
0 |
0 |
0.000 |
| Average: |
125.1 |
-1.3 |
0.374 |
0 |
1 |
0 |
0.000 |
| 14 |
25 |
|
[NAG]A:1000 |
10 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
19 |
7 |
11289 |
147.9 |
4.7 |
0.606 |
0 |
0 |
0 |
0.000 |
26 |
|
[NAG]C:1000 |
10 |
1 |
366 |
cf |
C |
x,y,z |
1_555 |
18 |
7 |
11242 |
146.6 |
4.6 |
0.606 |
0 |
0 |
0 |
0.000 |
| Average: |
147.2 |
4.7 |
0.606 |
0 |
0 |
0 |
0.000 |
| 15 |
27 |
|
I |
15 |
5 |
1839 |
◊ |
E |
x,y,z |
1_555 |
15 |
3 |
12279 |
130.3 |
1.0 |
0.788 |
4 |
0 |
0 |
0.000 |
28 |
|
J |
14 |
5 |
1836 |
◊ |
G |
x,y,z |
1_555 |
14 |
3 |
12187 |
129.6 |
1.1 |
0.808 |
4 |
0 |
0 |
0.000 |
| Average: |
129.9 |
1.0 |
0.798 |
4 |
0 |
0 |
0.000 |
| 16 |
29 |
|
E |
14 |
3 |
12279 |
◊ |
C |
x,y,z |
1_555 |
14 |
4 |
11242 |
116.1 |
-1.2 |
0.350 |
0 |
0 |
0 |
0.000 |
30 |
|
G |
15 |
3 |
12187 |
◊ |
A |
x,y,z |
1_555 |
14 |
4 |
11289 |
114.3 |
-1.3 |
0.335 |
0 |
0 |
0 |
0.000 |
| Average: |
115.2 |
-1.3 |
0.343 |
0 |
0 |
0 |
0.000 |
| 17 |
31 |
|
H |
17 |
4 |
12793 |
◊ |
D |
x-1,y-1,z |
1_445 |
11 |
3 |
11194 |
100.6 |
-0.6 |
0.560 |
1 |
0 |
0 |
0.000 |
32 |
|
B |
9 |
3 |
11068 |
◊ |
F |
x,y-1,z |
1_545 |
13 |
3 |
12970 |
81.5 |
-0.5 |
0.554 |
0 |
0 |
0 |
0.000 |
| Average: |
91.1 |
-0.5 |
0.557 |
1 |
0 |
0 |
0.000 |
| 18 |
33 |
|
[FUC]D:1003 |
9 |
1 |
273 |
f |
D |
x,y,z |
1_555 |
15 |
4 |
11194 |
94.5 |
1.5 |
0.249 |
1 |
0 |
0 |
0.000 |
| 19 |
34 |
|
[FUC]B:1003 |
8 |
1 |
280 |
f |
B |
x,y,z |
1_555 |
15 |
4 |
11068 |
88.3 |
1.8 |
0.344 |
2 |
0 |
0 |
0.000 |
| 20 |
35 |
|
[NAG]D:1000 |
10 |
1 |
356 |
cf |
D |
x,y,z |
1_555 |
11 |
3 |
11194 |
83.8 |
1.8 |
0.232 |
0 |
0 |
0 |
0.000 |
36 |
|
[NAG]B:1000 |
10 |
1 |
365 |
cf |
B |
x,y,z |
1_555 |
9 |
2 |
11068 |
80.6 |
1.7 |
0.285 |
0 |
0 |
0 |
0.000 |
| Average: |
82.2 |
1.8 |
0.258 |
0 |
0 |
0 |
0.000 |
| 21 |
37 |
|
[FUC]D:1002 |
7 |
1 |
279 |
cf |
[NAG]D:1000 |
x,y,z |
1_555 |
8 |
1 |
356 |
72.2 |
2.6 |
0.125 |
0 |
0 |
0 |
0.000 |
38 |
|
[FUC]B:1002 |
7 |
1 |
282 |
cf |
[NAG]B:1000 |
x,y,z |
1_555 |
7 |
1 |
365 |
66.9 |
2.4 |
0.140 |
0 |
0 |
0 |
0.000 |
| Average: |
69.6 |
2.5 |
0.133 |
0 |
0 |
0 |
0.000 |
| 22 |
39 |
|
[NAG]B:1001 |
8 |
1 |
361 |
cf |
[NAG]B:1000 |
x,y,z |
1_555 |
7 |
1 |
365 |
71.4 |
1.3 |
0.091 |
0 |
0 |
0 |
0.000 |
| 23 |
40 |
|
[NAG]D:1001 |
8 |
1 |
355 |
cf |
[NAG]D:1000 |
x,y,z |
1_555 |
6 |
1 |
356 |
71.4 |
1.3 |
0.084 |
0 |
0 |
0 |
0.000 |
| 24 |
41 |
|
[FUC]D:1002 |
8 |
1 |
279 |
f |
[NAG]D:1001 |
x,y,z |
1_555 |
9 |
1 |
355 |
70.9 |
3.4 |
0.163 |
0 |
0 |
0 |
0.000 |
| 25 |
42 |
|
H |
11 |
3 |
12793 |
◊ |
[MAN]B:1005 |
x-1,y,z |
1_455 |
5 |
1 |
293 |
65.9 |
0.8 |
0.362 |
0 |
0 |
0 |
0.000 |
| 26 |
43 |
|
[FUC]B:1002 |
8 |
1 |
282 |
f |
[NAG]B:1001 |
x,y,z |
1_555 |
6 |
1 |
361 |
65.3 |
2.8 |
0.193 |
0 |
0 |
0 |
0.000 |
| 27 |
44 |
|
[FUC]B:1003 |
7 |
1 |
280 |
cf |
[NAG]B:1000 |
x,y,z |
1_555 |
5 |
1 |
365 |
62.0 |
1.7 |
0.133 |
0 |
0 |
0 |
0.000 |
| 28 |
45 |
|
[FUC]D:1003 |
5 |
1 |
273 |
cf |
[NAG]D:1000 |
x,y,z |
1_555 |
5 |
1 |
356 |
61.7 |
2.7 |
0.284 |
0 |
0 |
0 |
0.000 |
| 29 |
46 |
|
C |
5 |
2 |
11242 |
◊ |
A |
x,y,z-1 |
1_554 |
10 |
5 |
11289 |
61.2 |
-1.3 |
0.327 |
0 |
0 |
0 |
0.000 |
| 30 |
47 |
|
[MAN]B:1005 |
6 |
1 |
293 |
cf |
[MAN]B:1004 |
x,y,z |
1_555 |
6 |
1 |
288 |
59.8 |
0.8 |
0.123 |
0 |
0 |
0 |
0.000 |
| 31 |
48 |
|
[MAN]B:1004 |
6 |
1 |
288 |
cf |
[NAG]B:1001 |
x,y,z |
1_555 |
6 |
1 |
361 |
59.2 |
1.0 |
0.125 |
0 |
0 |
0 |
0.000 |
| 32 |
49 |
|
G |
5 |
3 |
12187 |
◊ |
E |
x,y,z |
1_555 |
4 |
1 |
12279 |
47.0 |
0.2 |
0.609 |
1 |
0 |
0 |
0.000 |
| 33 |
50 |
|
A |
9 |
3 |
11289 |
◊ |
[FUC]B:1002 |
x-1,y,z |
1_455 |
4 |
1 |
282 |
46.4 |
1.1 |
0.458 |
0 |
0 |
0 |
0.000 |
51 |
|
C |
8 |
3 |
11242 |
◊ |
[FUC]D:1002 |
x-1,y,z |
1_455 |
4 |
1 |
279 |
36.6 |
0.8 |
0.465 |
0 |
0 |
0 |
0.000 |
| Average: |
41.5 |
0.9 |
0.461 |
0 |
0 |
0 |
0.000 |
| 34 |
52 |
|
A |
3 |
1 |
11289 |
◊ |
[MAN]B:1005 |
x-1,y,z |
1_455 |
5 |
1 |
293 |
40.5 |
2.1 |
0.420 |
1 |
0 |
0 |
0.000 |
| 35 |
53 |
|
D |
6 |
3 |
11194 |
◊ |
B |
x,y-1,z-1 |
1_544 |
7 |
3 |
11068 |
37.3 |
-0.3 |
0.632 |
0 |
0 |
0 |
0.000 |
| 36 |
54 |
|
J |
4 |
1 |
1836 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
12279 |
32.0 |
0.5 |
0.781 |
0 |
0 |
0 |
0.000 |
| 37 |
55 |
|
H |
1 |
1 |
12793 |
◊ |
[MAN]B:1004 |
x-1,y,z |
1_455 |
3 |
1 |
288 |
27.5 |
1.2 |
0.575 |
0 |
0 |
0 |
0.000 |
| 38 |
56 |
|
A |
4 |
2 |
11289 |
◊ |
[MAN]B:1004 |
x-1,y,z |
1_455 |
2 |
1 |
288 |
23.8 |
0.5 |
0.490 |
0 |
0 |
0 |
0.000 |
| 39 |
57 |
|
[FUC]B:1003 |
1 |
1 |
280 |
f |
[NAG]B:1001 |
x,y,z |
1_555 |
4 |
1 |
361 |
21.2 |
1.4 |
0.437 |
0 |
0 |
0 |
0.000 |
| 40 |
58 |
|
A |
3 |
1 |
11289 |
◊ |
[NAG]B:1001 |
x-1,y,z |
1_455 |
5 |
1 |
361 |
20.2 |
0.7 |
0.311 |
0 |
0 |
0 |
0.000 |
| 41 |
59 |
|
[FUC]D:1003 |
2 |
1 |
273 |
f |
[NAG]D:1001 |
x,y,z |
1_555 |
5 |
1 |
355 |
19.7 |
1.0 |
0.217 |
0 |
0 |
0 |
0.000 |
| 42 |
60 |
|
E |
1 |
1 |
12279 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
11068 |
9.9 |
-0.0 |
0.422 |
0 |
0 |
0 |
0.000 |
| 43 |
61 |
|
C |
1 |
1 |
11242 |
◊ |
[NAG]D:1001 |
x-1,y,z |
1_455 |
3 |
1 |
355 |
8.8 |
0.2 |
0.430 |
0 |
0 |
0 |
0.000 |
| 44 |
62 |
|
A |
1 |
1 |
11289 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
11068 |
8.3 |
-0.3 |
0.276 |
0 |
0 |
0 |
0.000 |
| 45 |
63 |
|
[FUC]D:1002 |
1 |
1 |
279 |
f |
D |
x,y,z |
1_555 |
2 |
2 |
11194 |
6.4 |
0.3 |
0.384 |
0 |
0 |
0 |
0.000 |
64 |
|
[FUC]B:1002 |
1 |
1 |
282 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
11068 |
4.9 |
0.2 |
0.395 |
0 |
0 |
0 |
0.000 |
| Average: |
5.7 |
0.3 |
0.389 |
0 |
0 |
0 |
0.000 |
| 46 |
65 |
|
[NAG]D:1001 |
1 |
1 |
355 |
f |
D |
x,y,z |
1_555 |
2 |
1 |
11194 |
3.7 |
0.2 |
0.388 |
0 |
0 |
0 |
0.000 |
| 47 |
66 |
|
B |
1 |
1 |
11068 |
◊ |
E |
x,y-1,z |
1_545 |
1 |
1 |
12279 |
2.6 |
-0.1 |
0.446 |
0 |
0 |
0 |
0.000 |
| 48 |
67 |
|
F |
2 |
1 |
12970 |
◊ |
G |
x,y,z |
1_555 |
1 |
1 |
12187 |
0.6 |
0.0 |
0.625 |
0 |
0 |
0 |
0.000 |
| 49 |
68 |
|
[NAG]B:1001 |
1 |
1 |
361 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
11068 |
0.6 |
0.0 |
0.293 |
0 |
0 |
0 |
0.000 |
|