## |
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 |
62 |
21 |
16642 |
x |
B |
x-1,y,z |
1_455 |
62 |
18 |
16642 |
570.3 |
-3.4 |
0.465 |
7 |
0 |
0 |
0.000 |
2 |
|
A |
65 |
18 |
16669 |
x |
A |
x-1,y,z |
1_455 |
63 |
21 |
16669 |
568.1 |
-3.5 |
0.462 |
6 |
0 |
0 |
0.000 |
Average: |
569.2 |
-3.4 |
0.464 |
7 |
0 |
0 |
0.000 |
2 |
3 |
|
B |
48 |
18 |
16642 |
x |
B |
-x-1,y-1/2,-z+1 |
2_446 |
44 |
14 |
16642 |
484.5 |
-0.7 |
0.607 |
9 |
0 |
0 |
0.000 |
3 |
4 |
|
A |
48 |
18 |
16669 |
x |
A |
-x+1,y-1/2,-z+2 |
2_647 |
44 |
14 |
16669 |
458.2 |
-1.6 |
0.548 |
5 |
0 |
0 |
0.000 |
4 |
5 |
|
B |
37 |
15 |
16642 |
◊ |
A |
x-2,y,z |
1_355 |
34 |
12 |
16669 |
348.5 |
-2.8 |
0.407 |
1 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
41 |
12 |
16642 |
◊ |
A |
x,y,z |
1_555 |
41 |
11 |
16669 |
337.4 |
-4.9 |
0.246 |
0 |
0 |
0 |
0.000 |
6 |
7 |
|
[C5H]A:308 |
27 |
1 |
781 |
f |
A |
x,y,z |
1_555 |
43 |
18 |
16669 |
336.6 |
4.4 |
0.909 |
14 |
0 |
0 |
0.000 |
8 |
|
[C5H]B:308 |
27 |
1 |
780 |
f |
B |
x,y,z |
1_555 |
41 |
19 |
16642 |
331.7 |
4.5 |
0.917 |
14 |
0 |
0 |
0.000 |
Average: |
334.2 |
4.4 |
0.913 |
14 |
0 |
0 |
0.000 |
7 |
9 |
|
B |
40 |
9 |
16642 |
◊ |
A |
x-3,y,z |
1_255 |
38 |
10 |
16669 |
327.7 |
-4.1 |
0.302 |
2 |
0 |
0 |
0.000 |
8 |
10 |
|
B |
29 |
9 |
16642 |
◊ |
A |
x-1,y,z |
1_455 |
29 |
9 |
16669 |
281.1 |
-0.7 |
0.616 |
2 |
0 |
0 |
0.000 |
9 |
11 |
|
A |
21 |
7 |
16669 |
x |
A |
x-2,y+1,z |
1_365 |
21 |
9 |
16669 |
196.6 |
-1.7 |
0.404 |
0 |
0 |
0 |
0.000 |
10 |
12 |
|
[NAG]A:304 |
14 |
1 |
363 |
◊ |
A |
x-1,y,z |
1_455 |
31 |
14 |
16669 |
194.7 |
3.7 |
0.331 |
3 |
0 |
0 |
0.000 |
11 |
13 |
|
B |
30 |
14 |
16642 |
◊ |
[NAG]B:304 |
x-1,y,z |
1_455 |
13 |
1 |
359 |
182.0 |
3.1 |
0.347 |
3 |
0 |
0 |
0.000 |
12 |
14 |
|
[NAG]A:302 |
13 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
19 |
6 |
16669 |
151.3 |
3.2 |
0.317 |
0 |
0 |
0 |
0.000 |
15 |
|
[NAG]B:302 |
13 |
1 |
366 |
cf |
B |
x,y,z |
1_555 |
19 |
6 |
16642 |
150.6 |
3.2 |
0.320 |
0 |
0 |
0 |
0.000 |
Average: |
150.9 |
3.2 |
0.318 |
0 |
0 |
0 |
0.000 |
13 |
16 |
|
[NAG]A:306 |
12 |
1 |
365 |
◊ |
A |
-x,y-1/2,-z+2 |
2_547 |
20 |
8 |
16669 |
148.9 |
3.4 |
0.362 |
2 |
0 |
0 |
0.000 |
14 |
17 |
|
[NAG]B:303 |
12 |
1 |
362 |
cf |
B |
x,y,z |
1_555 |
22 |
8 |
16642 |
147.0 |
4.3 |
0.493 |
2 |
0 |
0 |
0.000 |
18 |
|
[NAG]A:303 |
11 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
22 |
8 |
16669 |
144.6 |
4.3 |
0.520 |
2 |
0 |
0 |
0.000 |
Average: |
145.8 |
4.3 |
0.506 |
2 |
0 |
0 |
0.000 |
15 |
19 |
|
[NAG]A:307 |
12 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
13 |
5 |
16669 |
124.0 |
4.2 |
0.453 |
0 |
0 |
0 |
0.000 |
20 |
|
[NAG]B:307 |
12 |
1 |
364 |
cf |
B |
x,y,z |
1_555 |
14 |
5 |
16642 |
124.0 |
4.2 |
0.443 |
0 |
0 |
0 |
0.000 |
Average: |
124.0 |
4.2 |
0.448 |
0 |
0 |
0 |
0.000 |
16 |
21 |
|
[NAG]A:301 |
10 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
13 |
7 |
16669 |
120.8 |
3.4 |
0.442 |
0 |
0 |
0 |
0.000 |
22 |
|
[NAG]B:301 |
10 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
13 |
7 |
16642 |
120.3 |
3.4 |
0.422 |
0 |
0 |
0 |
0.000 |
Average: |
120.5 |
3.4 |
0.432 |
0 |
0 |
0 |
0.000 |
17 |
23 |
|
[NAG]A:305 |
11 |
1 |
358 |
cf |
A |
x,y,z |
1_555 |
11 |
7 |
16669 |
106.5 |
3.7 |
0.375 |
2 |
0 |
0 |
0.000 |
24 |
|
[NAG]B:305 |
11 |
1 |
357 |
cf |
B |
x,y,z |
1_555 |
11 |
7 |
16642 |
104.8 |
3.6 |
0.377 |
2 |
0 |
0 |
0.000 |
Average: |
105.7 |
3.6 |
0.376 |
2 |
0 |
0 |
0.000 |
18 |
25 |
|
B |
14 |
6 |
16642 |
x |
B |
x-2,y-1,z |
1_345 |
11 |
5 |
16642 |
88.5 |
-0.2 |
0.599 |
0 |
0 |
0 |
0.000 |
19 |
26 |
|
[NAG]A:304 |
7 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
8 |
3 |
16669 |
75.1 |
2.6 |
0.497 |
0 |
0 |
0 |
0.000 |
27 |
|
[NAG]B:304 |
7 |
1 |
359 |
cf |
B |
x,y,z |
1_555 |
8 |
3 |
16642 |
74.3 |
2.5 |
0.516 |
0 |
0 |
0 |
0.000 |
Average: |
74.7 |
2.6 |
0.507 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[NAG]B:303 |
10 |
1 |
362 |
◊ |
[NAG]A:303 |
x-1,y,z |
1_455 |
10 |
1 |
361 |
73.5 |
2.8 |
0.095 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[NAG]B:306 |
9 |
1 |
365 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
12 |
6 |
16642 |
72.3 |
1.7 |
0.270 |
1 |
0 |
0 |
0.000 |
22 |
30 |
|
[NAG]B:305 |
7 |
1 |
357 |
◊ |
[NAG]A:302 |
x,y,z |
1_555 |
9 |
1 |
363 |
67.5 |
1.9 |
0.110 |
0 |
0 |
0 |
0.000 |
31 |
|
[NAG]B:302 |
8 |
1 |
366 |
◊ |
[NAG]A:305 |
x,y,z |
1_555 |
6 |
1 |
358 |
63.9 |
1.8 |
0.132 |
0 |
0 |
0 |
0.000 |
Average: |
65.7 |
1.8 |
0.121 |
0 |
0 |
0 |
0.000 |
23 |
32 |
|
[NAG]A:306 |
7 |
1 |
365 |
cf |
A |
x,y,z |
1_555 |
4 |
1 |
16669 |
59.0 |
1.8 |
0.379 |
0 |
0 |
0 |
0.000 |
33 |
|
[NAG]B:306 |
7 |
1 |
365 |
cf |
B |
x,y,z |
1_555 |
4 |
1 |
16642 |
58.6 |
1.8 |
0.380 |
0 |
0 |
0 |
0.000 |
Average: |
58.8 |
1.8 |
0.379 |
0 |
0 |
0 |
0.000 |
24 |
34 |
|
A |
8 |
5 |
16669 |
x |
A |
-x,y-1/2,-z+2 |
2_547 |
10 |
5 |
16669 |
52.8 |
-0.1 |
0.554 |
0 |
0 |
0 |
0.000 |
25 |
35 |
|
B |
10 |
5 |
16642 |
◊ |
[NAG]A:303 |
x-1,y,z |
1_455 |
8 |
1 |
361 |
48.6 |
0.9 |
0.242 |
1 |
0 |
0 |
0.000 |
36 |
|
[NAG]B:303 |
8 |
1 |
362 |
◊ |
A |
x-1,y,z |
1_455 |
10 |
5 |
16669 |
48.6 |
0.9 |
0.251 |
1 |
0 |
0 |
0.000 |
Average: |
48.6 |
0.9 |
0.247 |
1 |
0 |
0 |
0.000 |
26 |
37 |
|
B |
7 |
2 |
16642 |
◊ |
[NAG]B:303 |
x-1,y,z |
1_455 |
4 |
1 |
362 |
45.6 |
-0.1 |
0.256 |
0 |
0 |
0 |
0.000 |
38 |
|
[NAG]A:303 |
4 |
1 |
361 |
◊ |
A |
x-1,y,z |
1_455 |
7 |
2 |
16669 |
44.3 |
-0.2 |
0.249 |
0 |
0 |
0 |
0.000 |
Average: |
44.9 |
-0.1 |
0.253 |
0 |
0 |
0 |
0.000 |
27 |
39 |
|
[NAG]A:305 |
3 |
1 |
358 |
◊ |
A |
x-1,y,z |
1_455 |
5 |
2 |
16669 |
43.7 |
0.7 |
0.481 |
0 |
0 |
0 |
0.000 |
40 |
|
B |
6 |
2 |
16642 |
◊ |
[NAG]B:305 |
x-1,y,z |
1_455 |
3 |
1 |
357 |
42.3 |
0.7 |
0.496 |
0 |
0 |
0 |
0.000 |
Average: |
43.0 |
0.7 |
0.488 |
0 |
0 |
0 |
0.000 |
28 |
41 |
|
[NAG]A:301 |
4 |
1 |
361 |
◊ |
A |
-x,y-1/2,-z+2 |
2_547 |
5 |
1 |
16669 |
36.6 |
0.1 |
0.243 |
0 |
0 |
0 |
0.000 |
29 |
42 |
|
[NAG]B:305 |
4 |
1 |
357 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
16669 |
36.5 |
-0.1 |
0.142 |
0 |
0 |
0 |
0.000 |
43 |
|
[NAG]A:305 |
3 |
1 |
358 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
16642 |
35.2 |
-0.2 |
0.087 |
0 |
0 |
0 |
0.000 |
Average: |
35.8 |
-0.1 |
0.115 |
0 |
0 |
0 |
0.000 |
30 |
44 |
|
[NAG]B:304 |
3 |
1 |
359 |
◊ |
A |
x-2,y,z |
1_355 |
4 |
2 |
16669 |
33.9 |
0.9 |
0.435 |
1 |
0 |
0 |
0.000 |
31 |
45 |
|
[CA]A:309 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
16669 |
31.2 |
-8.3 |
0.000 |
0 |
0 |
0 |
0.000 |
46 |
|
[CA]B:309 |
1 |
1 |
85 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
16642 |
31.1 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
31.2 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.000 |
32 |
47 |
|
[CA]B:309 |
1 |
1 |
85 |
f |
[C5H]B:308 |
x,y,z |
1_555 |
4 |
1 |
780 |
27.3 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.000 |
48 |
|
[CA]A:309 |
1 |
1 |
85 |
f |
[C5H]A:308 |
x,y,z |
1_555 |
4 |
1 |
781 |
26.7 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
27.0 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
49 |
|
B |
3 |
1 |
16642 |
◊ |
[NAG]B:306 |
-x-2,y-1/2,-z+1 |
2_346 |
2 |
1 |
365 |
25.7 |
0.8 |
0.666 |
0 |
0 |
0 |
0.000 |
34 |
50 |
|
[NAG]B:304 |
4 |
1 |
359 |
◊ |
[NAG]A:304 |
x-1,y,z |
1_455 |
4 |
1 |
363 |
23.9 |
0.5 |
0.175 |
1 |
0 |
0 |
0.000 |
35 |
51 |
|
B |
3 |
3 |
16642 |
x |
B |
-x,y-1/2,-z+1 |
2_546 |
6 |
3 |
16642 |
21.6 |
-0.4 |
0.417 |
0 |
0 |
0 |
0.000 |
36 |
52 |
|
[C5H]A:308 |
4 |
1 |
781 |
◊ |
A |
x-2,y+1,z |
1_365 |
4 |
4 |
16669 |
20.6 |
-0.3 |
0.478 |
0 |
0 |
0 |
0.000 |
37 |
53 |
|
[NAG]A:304 |
3 |
1 |
363 |
f |
[NAG]A:303 |
x,y,z |
1_555 |
2 |
1 |
361 |
19.3 |
0.5 |
0.216 |
1 |
0 |
0 |
0.000 |
38 |
54 |
|
[NAG]B:304 |
3 |
1 |
359 |
f |
[NAG]B:303 |
x,y,z |
1_555 |
2 |
1 |
362 |
19.1 |
0.5 |
0.215 |
1 |
0 |
0 |
0.000 |
39 |
55 |
|
B |
1 |
1 |
16642 |
◊ |
[NAG]A:304 |
x-2,y,z |
1_355 |
2 |
1 |
363 |
6.1 |
0.2 |
0.392 |
0 |
0 |
0 |
0.000 |
40 |
56 |
|
B |
1 |
1 |
16642 |
x |
B |
-x-2,y-1/2,-z+1 |
2_346 |
1 |
1 |
16642 |
3.1 |
0.1 |
0.588 |
0 |
0 |
0 |
0.000 |
41 |
57 |
|
[NAG]B:301 |
1 |
1 |
363 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
3 |
1 |
16642 |
1.9 |
-0.0 |
0.285 |
0 |
0 |
0 |
0.000 |
42 |
58 |
|
B |
1 |
1 |
16642 |
◊ |
[NAG]A:303 |
x-2,y,z |
1_355 |
1 |
1 |
361 |
1.3 |
0.0 |
0.264 |
0 |
0 |
0 |
0.000 |
59 |
|
[NAG]B:303 |
1 |
1 |
362 |
◊ |
A |
x-2,y,z |
1_355 |
1 |
1 |
16669 |
0.6 |
0.0 |
0.280 |
0 |
0 |
0 |
0.000 |
Average: |
0.9 |
0.0 |
0.272 |
0 |
0 |
0 |
0.000 |
|