| ## |
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 |
321 |
81 |
12559 |
◊ |
E |
x,y,z |
1_555 |
259 |
60 |
17033 |
2772.9 |
-27.2 |
0.085 |
50 |
17 |
1 |
1.000 |
2 |
|
B |
312 |
81 |
12536 |
◊ |
A |
x,y,z |
1_555 |
260 |
59 |
17109 |
2772.0 |
-27.8 |
0.072 |
51 |
17 |
1 |
1.000 |
3 |
|
D |
316 |
81 |
12427 |
◊ |
C |
x,y,z |
1_555 |
256 |
60 |
16964 |
2769.8 |
-27.5 |
0.084 |
51 |
17 |
1 |
1.000 |
| Average: |
2771.6 |
-27.5 |
0.080 |
51 |
17 |
1 |
1.000 |
| 2 |
4 |
|
F |
107 |
27 |
12559 |
◊ |
B |
x,y,z |
1_555 |
133 |
35 |
12536 |
1213.7 |
-12.5 |
0.303 |
9 |
6 |
0 |
1.000 |
5 |
|
F |
128 |
37 |
12559 |
◊ |
D |
x,y,z |
1_555 |
107 |
27 |
12427 |
1185.6 |
-12.9 |
0.277 |
8 |
6 |
0 |
1.000 |
6 |
|
D |
129 |
33 |
12427 |
◊ |
B |
x,y,z |
1_555 |
102 |
25 |
12536 |
1150.8 |
-14.7 |
0.194 |
9 |
6 |
0 |
1.000 |
| Average: |
1183.4 |
-13.3 |
0.258 |
9 |
6 |
0 |
1.000 |
| 3 |
7 |
|
C |
53 |
14 |
16964 |
◊ |
A |
x,y,z |
1_555 |
51 |
15 |
17109 |
485.7 |
-0.4 |
0.551 |
5 |
0 |
0 |
0.036 |
8 |
|
E |
54 |
14 |
17033 |
◊ |
C |
x,y,z |
1_555 |
54 |
16 |
16964 |
482.3 |
-0.1 |
0.573 |
5 |
0 |
0 |
0.036 |
9 |
|
E |
52 |
15 |
17033 |
◊ |
A |
x,y,z |
1_555 |
48 |
14 |
17109 |
478.4 |
-0.2 |
0.555 |
5 |
0 |
0 |
0.036 |
| Average: |
482.1 |
-0.2 |
0.560 |
5 |
0 |
0 |
0.036 |
| 4 |
10 |
|
C |
52 |
18 |
16964 |
◊ |
C |
-x+3,y,-z+1 |
2_856 |
52 |
18 |
16964 |
457.6 |
2.8 |
0.777 |
8 |
0 |
0 |
0.000 |
11 |
|
E |
46 |
15 |
17033 |
◊ |
A |
-x+5/2,y-1/2,-z+1 |
4_746 |
50 |
18 |
17109 |
443.8 |
1.9 |
0.711 |
6 |
0 |
0 |
0.000 |
| Average: |
450.7 |
2.3 |
0.744 |
7 |
0 |
0 |
0.000 |
| 5 |
12 |
|
F |
41 |
9 |
12559 |
◊ |
A |
x,y,z |
1_555 |
48 |
16 |
17109 |
432.8 |
-3.6 |
0.364 |
6 |
3 |
0 |
0.099 |
13 |
|
D |
42 |
9 |
12427 |
◊ |
E |
x,y,z |
1_555 |
48 |
17 |
17033 |
428.6 |
-3.6 |
0.372 |
6 |
3 |
0 |
0.099 |
14 |
|
B |
40 |
10 |
12536 |
◊ |
C |
x,y,z |
1_555 |
48 |
15 |
16964 |
408.6 |
-3.7 |
0.359 |
6 |
3 |
0 |
0.099 |
| Average: |
423.3 |
-3.7 |
0.365 |
6 |
3 |
0 |
0.099 |
| 6 |
15 |
|
F |
42 |
12 |
12559 |
◊ |
C |
x,y,z |
1_555 |
24 |
8 |
16964 |
287.1 |
-2.4 |
0.351 |
4 |
0 |
0 |
0.057 |
16 |
|
B |
42 |
13 |
12536 |
◊ |
E |
x,y,z |
1_555 |
28 |
8 |
17033 |
286.0 |
-2.5 |
0.332 |
3 |
0 |
0 |
0.057 |
17 |
|
D |
42 |
12 |
12427 |
◊ |
A |
x,y,z |
1_555 |
26 |
8 |
17109 |
283.0 |
-2.3 |
0.339 |
3 |
0 |
0 |
0.057 |
| Average: |
285.4 |
-2.4 |
0.341 |
3 |
0 |
0 |
0.057 |
| 7 |
18 |
|
D |
26 |
9 |
12427 |
◊ |
B |
-x+5/2,y-1/2,-z |
4_745 |
26 |
9 |
12536 |
205.9 |
0.7 |
0.804 |
7 |
0 |
0 |
0.000 |
19 |
|
F |
24 |
9 |
12559 |
◊ |
F |
-x+2,y,-z |
2_755 |
25 |
9 |
12559 |
200.7 |
0.8 |
0.803 |
7 |
0 |
0 |
0.000 |
| Average: |
203.3 |
0.7 |
0.803 |
7 |
0 |
0 |
0.000 |
| 8 |
20 |
|
[NAG]A:505 |
12 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
20 |
6 |
17109 |
150.2 |
3.4 |
0.398 |
2 |
0 |
0 |
0.000 |
21 |
|
[NAG]C:505 |
12 |
1 |
362 |
cf |
C |
x,y,z |
1_555 |
20 |
6 |
16964 |
149.4 |
3.3 |
0.392 |
2 |
0 |
0 |
0.000 |
22 |
|
[NAG]E:505 |
12 |
1 |
361 |
cf |
E |
x,y,z |
1_555 |
20 |
6 |
17033 |
148.8 |
3.4 |
0.396 |
2 |
0 |
0 |
0.000 |
| Average: |
149.5 |
3.4 |
0.395 |
2 |
0 |
0 |
0.000 |
| 9 |
23 |
|
[NAG]A:502 |
11 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
25 |
8 |
17109 |
146.7 |
4.7 |
0.528 |
2 |
0 |
0 |
0.000 |
24 |
|
[NAG]E:502 |
12 |
1 |
362 |
cf |
E |
x,y,z |
1_555 |
26 |
8 |
17033 |
143.2 |
4.8 |
0.490 |
1 |
0 |
0 |
0.000 |
25 |
|
[NAG]C:502 |
11 |
1 |
361 |
cf |
C |
x,y,z |
1_555 |
25 |
8 |
16964 |
140.9 |
4.7 |
0.506 |
1 |
0 |
0 |
0.000 |
| Average: |
143.6 |
4.7 |
0.508 |
1 |
0 |
0 |
0.000 |
| 10 |
26 |
|
D |
17 |
5 |
12427 |
◊ |
C |
-x+3,y,-z+1 |
2_856 |
13 |
3 |
16964 |
136.2 |
1.4 |
0.813 |
3 |
3 |
0 |
0.000 |
27 |
|
E |
13 |
3 |
17033 |
◊ |
B |
-x+5/2,y-1/2,-z+1 |
4_746 |
18 |
5 |
12536 |
134.7 |
1.3 |
0.798 |
3 |
3 |
0 |
0.000 |
28 |
|
F |
18 |
5 |
12559 |
◊ |
A |
-x+5/2,y-1/2,-z+1 |
4_746 |
13 |
3 |
17109 |
133.9 |
1.3 |
0.803 |
3 |
3 |
0 |
0.000 |
| Average: |
134.9 |
1.3 |
0.805 |
3 |
3 |
0 |
0.000 |
| 11 |
29 |
|
[NAG]E:501 |
9 |
1 |
358 |
cf |
E |
x,y,z |
1_555 |
19 |
7 |
17033 |
126.4 |
4.4 |
0.528 |
1 |
0 |
0 |
0.000 |
30 |
|
[NAG]C:501 |
9 |
1 |
358 |
cf |
C |
x,y,z |
1_555 |
18 |
7 |
16964 |
126.3 |
4.5 |
0.543 |
1 |
0 |
0 |
0.000 |
31 |
|
[NAG]A:501 |
9 |
1 |
356 |
cf |
A |
x,y,z |
1_555 |
19 |
7 |
17109 |
125.6 |
4.4 |
0.536 |
1 |
0 |
0 |
0.000 |
| Average: |
126.1 |
4.4 |
0.536 |
1 |
0 |
0 |
0.000 |
| 12 |
32 |
|
[NAG]C:506 |
10 |
1 |
365 |
cf |
[NAG]C:505 |
x,y,z |
1_555 |
6 |
1 |
362 |
71.1 |
1.3 |
0.083 |
1 |
0 |
0 |
0.000 |
33 |
|
[NAG]A:506 |
10 |
1 |
364 |
cf |
[NAG]A:505 |
x,y,z |
1_555 |
6 |
1 |
362 |
70.8 |
1.6 |
0.086 |
1 |
0 |
0 |
0.000 |
34 |
|
[NAG]E:506 |
10 |
1 |
361 |
cf |
[NAG]E:505 |
x,y,z |
1_555 |
6 |
1 |
361 |
69.7 |
1.5 |
0.094 |
0 |
0 |
0 |
0.000 |
| Average: |
70.5 |
1.5 |
0.088 |
1 |
0 |
0 |
0.000 |
| 13 |
35 |
|
[NAG]C:504 |
10 |
1 |
365 |
cf |
[NAG]C:502 |
x,y,z |
1_555 |
7 |
1 |
361 |
70.1 |
1.2 |
0.064 |
0 |
0 |
0 |
0.000 |
36 |
|
[NAG]A:504 |
9 |
1 |
364 |
cf |
[NAG]A:502 |
x,y,z |
1_555 |
7 |
1 |
361 |
69.5 |
1.2 |
0.080 |
0 |
0 |
0 |
0.000 |
37 |
|
[NAG]E:504 |
9 |
1 |
362 |
cf |
[NAG]E:502 |
x,y,z |
1_555 |
7 |
1 |
362 |
69.5 |
1.2 |
0.074 |
0 |
0 |
0 |
0.000 |
| Average: |
69.7 |
1.2 |
0.073 |
0 |
0 |
0 |
0.000 |
| 14 |
38 |
|
[FUC]C:503 |
5 |
1 |
285 |
cf |
[NAG]C:502 |
x,y,z |
1_555 |
5 |
1 |
361 |
55.6 |
2.5 |
0.313 |
0 |
0 |
0 |
0.000 |
39 |
|
[FUC]E:503 |
5 |
1 |
283 |
cf |
[NAG]E:502 |
x,y,z |
1_555 |
5 |
1 |
362 |
54.9 |
2.3 |
0.302 |
0 |
0 |
0 |
0.000 |
40 |
|
[FUC]A:503 |
5 |
1 |
281 |
cf |
[NAG]A:502 |
x,y,z |
1_555 |
5 |
1 |
361 |
54.8 |
2.3 |
0.302 |
0 |
0 |
0 |
0.000 |
| Average: |
55.1 |
2.4 |
0.305 |
0 |
0 |
0 |
0.000 |
| 15 |
41 |
|
[FUC]A:503 |
4 |
1 |
281 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
17109 |
44.7 |
1.2 |
0.359 |
0 |
0 |
0 |
0.000 |
42 |
|
[FUC]C:503 |
4 |
1 |
285 |
f |
C |
x,y,z |
1_555 |
5 |
2 |
16964 |
42.9 |
1.2 |
0.366 |
0 |
0 |
0 |
0.000 |
43 |
|
[FUC]E:503 |
4 |
1 |
283 |
f |
E |
x,y,z |
1_555 |
6 |
3 |
17033 |
42.3 |
1.1 |
0.375 |
0 |
0 |
0 |
0.000 |
| Average: |
43.3 |
1.2 |
0.367 |
0 |
0 |
0 |
0.000 |
| 16 |
44 |
|
[FUC]C:503 |
3 |
1 |
285 |
f |
[NAG]C:504 |
x,y,z |
1_555 |
5 |
1 |
365 |
39.4 |
2.2 |
0.277 |
0 |
0 |
0 |
0.000 |
45 |
|
[FUC]A:503 |
2 |
1 |
281 |
f |
[NAG]A:504 |
x,y,z |
1_555 |
7 |
1 |
364 |
36.9 |
2.0 |
0.339 |
0 |
0 |
0 |
0.000 |
46 |
|
[FUC]E:503 |
2 |
1 |
283 |
f |
[NAG]E:504 |
x,y,z |
1_555 |
7 |
1 |
362 |
36.7 |
2.0 |
0.305 |
0 |
0 |
0 |
0.000 |
| Average: |
37.7 |
2.1 |
0.307 |
0 |
0 |
0 |
0.000 |
| 17 |
47 |
|
[NAG]A:504 |
3 |
1 |
364 |
f |
A |
x,y,z |
1_555 |
5 |
1 |
17109 |
37.9 |
0.5 |
0.385 |
0 |
0 |
0 |
0.000 |
48 |
|
[NAG]E:504 |
3 |
1 |
362 |
f |
E |
x,y,z |
1_555 |
5 |
1 |
17033 |
35.6 |
0.4 |
0.347 |
0 |
0 |
0 |
0.000 |
49 |
|
[NAG]C:504 |
3 |
1 |
365 |
f |
C |
x,y,z |
1_555 |
4 |
1 |
16964 |
33.3 |
0.2 |
0.254 |
0 |
0 |
0 |
0.000 |
| Average: |
35.6 |
0.4 |
0.329 |
0 |
0 |
0 |
0.000 |
| 18 |
50 |
|
F |
4 |
1 |
12559 |
◊ |
A |
x-1/2,y-1/2,z-1 |
3_444 |
6 |
2 |
17109 |
25.9 |
-0.2 |
0.506 |
0 |
0 |
0 |
0.000 |
51 |
|
B |
3 |
1 |
12536 |
◊ |
C |
x-1/2,y+1/2,z-1 |
3_454 |
2 |
1 |
16964 |
16.9 |
-0.2 |
0.410 |
0 |
0 |
0 |
0.000 |
52 |
|
D |
1 |
1 |
12427 |
◊ |
E |
x,y,z-1 |
1_554 |
1 |
1 |
17033 |
0.3 |
-0.0 |
0.597 |
0 |
0 |
0 |
0.000 |
| Average: |
14.4 |
-0.1 |
0.505 |
0 |
0 |
0 |
0.000 |
| 19 |
53 |
|
[NAG]C:506 |
5 |
1 |
365 |
f |
C |
x,y,z |
1_555 |
2 |
2 |
16964 |
24.8 |
0.3 |
0.173 |
0 |
0 |
0 |
0.000 |
| 20 |
54 |
|
C |
1 |
1 |
16964 |
x |
A |
-x+3,y,-z+1 |
2_856 |
2 |
1 |
17109 |
22.4 |
0.6 |
0.881 |
1 |
0 |
0 |
0.000 |
55 |
|
C |
1 |
1 |
16964 |
x |
A |
-x+5/2,y-1/2,-z+1 |
4_746 |
1 |
1 |
17109 |
2.9 |
-0.0 |
0.521 |
0 |
0 |
0 |
0.000 |
56 |
|
E |
1 |
1 |
17033 |
x |
E |
-x+5/2,y-1/2,-z+1 |
4_746 |
1 |
1 |
17033 |
2.9 |
-0.0 |
0.535 |
0 |
0 |
0 |
0.000 |
| Average: |
9.4 |
0.2 |
0.646 |
0 |
0 |
0 |
0.000 |
| 21 |
57 |
|
[NAG]E:506 |
5 |
1 |
361 |
f |
E |
x,y,z |
1_555 |
2 |
2 |
17033 |
19.7 |
0.3 |
0.208 |
0 |
0 |
0 |
0.000 |
58 |
|
[NAG]A:506 |
5 |
1 |
364 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
17109 |
19.7 |
0.3 |
0.174 |
0 |
0 |
0 |
0.000 |
| Average: |
19.7 |
0.3 |
0.191 |
0 |
0 |
0 |
0.000 |
|