| ## |
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 |
368 |
85 |
10256 |
◊ |
A |
x,y,z |
1_555 |
374 |
87 |
10366 |
3798.6 |
-64.4 |
0.016 |
41 |
5 |
0 |
1.000 |
| 2 |
2 |
|
I |
92 |
25 |
11740 |
◊ |
C |
x,y,z |
1_555 |
73 |
24 |
11744 |
808.1 |
-1.4 |
0.690 |
9 |
2 |
0 |
0.000 |
3 |
|
E |
85 |
27 |
11946 |
◊ |
D |
x,y,z |
1_555 |
65 |
24 |
11640 |
717.3 |
-0.0 |
0.766 |
8 |
5 |
0 |
0.000 |
| Average: |
762.7 |
-0.7 |
0.728 |
9 |
4 |
0 |
0.000 |
| 3 |
4 |
|
E |
73 |
22 |
11946 |
◊ |
B |
x,y,z |
1_555 |
87 |
23 |
10256 |
738.0 |
-6.7 |
0.380 |
7 |
0 |
0 |
0.000 |
5 |
|
I |
71 |
20 |
11740 |
◊ |
A |
x,y,z |
1_555 |
86 |
23 |
10366 |
723.2 |
-6.3 |
0.474 |
7 |
1 |
0 |
0.000 |
| Average: |
730.6 |
-6.5 |
0.427 |
7 |
1 |
0 |
0.000 |
| 4 |
6 |
|
C |
86 |
25 |
11744 |
◊ |
A |
x,y,z |
1_555 |
70 |
23 |
10366 |
710.4 |
-0.4 |
0.772 |
7 |
7 |
0 |
0.000 |
7 |
|
D |
77 |
23 |
11640 |
◊ |
B |
x,y,z |
1_555 |
68 |
21 |
10256 |
638.5 |
-1.1 |
0.755 |
6 |
5 |
0 |
0.000 |
| Average: |
674.4 |
-0.8 |
0.763 |
7 |
6 |
0 |
0.000 |
| 5 |
8 |
|
C |
50 |
15 |
11744 |
◊ |
D |
-x-1/2,-y,z-1/2 |
2_454 |
44 |
14 |
11640 |
445.8 |
-4.3 |
0.299 |
1 |
0 |
0 |
0.000 |
| 6 |
9 |
|
I |
56 |
17 |
11740 |
x |
I |
x-1/2,-y+1/2,-z |
4_455 |
41 |
13 |
11740 |
419.6 |
-3.3 |
0.467 |
3 |
0 |
0 |
0.000 |
| 7 |
10 |
|
C |
35 |
12 |
11744 |
◊ |
B |
x,y,z |
1_555 |
32 |
8 |
10256 |
324.8 |
-2.6 |
0.412 |
5 |
0 |
0 |
0.000 |
11 |
|
D |
31 |
11 |
11640 |
◊ |
A |
x,y,z |
1_555 |
32 |
8 |
10366 |
290.1 |
-2.4 |
0.409 |
3 |
0 |
0 |
0.000 |
| Average: |
307.4 |
-2.5 |
0.411 |
4 |
0 |
0 |
0.000 |
| 8 |
12 |
|
[NAG]E:304 |
12 |
1 |
364 |
cf |
E |
x,y,z |
1_555 |
26 |
7 |
11946 |
175.4 |
4.0 |
0.484 |
0 |
0 |
0 |
0.000 |
| 9 |
13 |
|
[NAG]E:305 |
14 |
1 |
363 |
cf |
E |
x,y,z |
1_555 |
24 |
8 |
11946 |
171.0 |
4.8 |
0.449 |
1 |
0 |
0 |
0.000 |
14 |
|
[NAG]I:310 |
14 |
1 |
362 |
cf |
I |
x,y,z |
1_555 |
25 |
8 |
11740 |
164.6 |
4.4 |
0.411 |
2 |
0 |
0 |
0.000 |
| Average: |
167.8 |
4.6 |
0.430 |
2 |
0 |
0 |
0.000 |
| 10 |
15 |
|
[NAG]I:304 |
11 |
1 |
352 |
cf |
I |
x,y,z |
1_555 |
22 |
8 |
11740 |
168.7 |
4.3 |
0.511 |
0 |
0 |
0 |
0.000 |
| 11 |
16 |
|
[NAG]E:307 |
11 |
1 |
363 |
cf |
E |
x,y,z |
1_555 |
18 |
10 |
11946 |
154.3 |
3.7 |
0.469 |
0 |
0 |
0 |
0.000 |
| 12 |
17 |
|
[NAG]E:301 |
12 |
1 |
362 |
cf |
E |
x,y,z |
1_555 |
14 |
7 |
11946 |
136.7 |
3.2 |
0.350 |
0 |
0 |
0 |
0.000 |
18 |
|
[NAG]I:301 |
12 |
1 |
362 |
cf |
I |
x,y,z |
1_555 |
17 |
7 |
11740 |
131.5 |
3.1 |
0.327 |
0 |
0 |
0 |
0.000 |
| Average: |
134.1 |
3.2 |
0.339 |
0 |
0 |
0 |
0.000 |
| 13 |
19 |
|
[NAG]D:301 |
11 |
1 |
358 |
cf |
D |
x,y,z |
1_555 |
16 |
5 |
11640 |
131.9 |
3.4 |
0.412 |
0 |
0 |
0 |
0.000 |
| 14 |
20 |
|
[NAG]C:301 |
11 |
1 |
361 |
cf |
C |
x,y,z |
1_555 |
15 |
5 |
11744 |
131.6 |
3.7 |
0.446 |
0 |
0 |
0 |
0.000 |
| 15 |
21 |
|
E |
14 |
5 |
11946 |
x |
E |
x-1,y,z |
1_455 |
11 |
5 |
11946 |
109.1 |
0.2 |
0.433 |
0 |
0 |
0 |
0.000 |
| 16 |
22 |
|
[NAG]B:201 |
8 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
11 |
4 |
10256 |
95.2 |
2.9 |
0.509 |
0 |
0 |
0 |
0.000 |
| 17 |
23 |
|
[NAG]A:201 |
9 |
1 |
357 |
cf |
A |
x,y,z |
1_555 |
12 |
4 |
10366 |
87.5 |
2.4 |
0.354 |
0 |
0 |
0 |
0.000 |
| 18 |
24 |
|
[NAG]D:304 |
7 |
1 |
358 |
cf |
D |
x,y,z |
1_555 |
8 |
3 |
11640 |
85.4 |
2.6 |
0.522 |
0 |
0 |
0 |
0.000 |
| 19 |
25 |
|
[NAG]C:301 |
9 |
1 |
361 |
◊ |
D |
-x-1/2,-y,z-1/2 |
2_454 |
13 |
3 |
11640 |
83.3 |
0.8 |
0.226 |
0 |
0 |
0 |
0.000 |
| 20 |
26 |
|
[NAG]A:201 |
5 |
1 |
357 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
10256 |
78.1 |
2.3 |
0.610 |
1 |
0 |
0 |
0.000 |
| 21 |
27 |
|
[NAG]C:302 |
10 |
1 |
364 |
cf |
[NAG]C:301 |
x,y,z |
1_555 |
6 |
1 |
361 |
76.3 |
2.3 |
0.120 |
0 |
0 |
0 |
0.000 |
| 22 |
28 |
|
[NAG]D:302 |
9 |
1 |
358 |
cf |
[NAG]D:301 |
x,y,z |
1_555 |
6 |
1 |
358 |
76.0 |
2.0 |
0.112 |
0 |
0 |
0 |
0.000 |
| 23 |
29 |
|
[NAG]I:305 |
9 |
1 |
359 |
cf |
[NAG]I:304 |
x,y,z |
1_555 |
8 |
1 |
352 |
69.9 |
1.3 |
0.059 |
0 |
0 |
0 |
0.000 |
| 24 |
30 |
|
[NAG]I:310 |
9 |
1 |
362 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
10366 |
69.5 |
0.8 |
0.230 |
0 |
0 |
0 |
0.000 |
31 |
|
[NAG]E:305 |
6 |
1 |
363 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
10256 |
58.9 |
0.9 |
0.340 |
0 |
0 |
0 |
0.000 |
| Average: |
64.2 |
0.9 |
0.285 |
0 |
0 |
0 |
0.000 |
| 25 |
32 |
|
C |
13 |
3 |
11744 |
◊ |
[NAG]D:301 |
-x-1/2,-y,z-1/2 |
2_454 |
9 |
1 |
358 |
69.0 |
0.8 |
0.222 |
0 |
0 |
0 |
0.000 |
| 26 |
33 |
|
[NAG]E:306 |
9 |
1 |
363 |
cf |
[NAG]E:305 |
x,y,z |
1_555 |
8 |
1 |
363 |
67.7 |
0.9 |
0.042 |
1 |
0 |
0 |
0.000 |
| 27 |
34 |
|
[NAG]I:311 |
9 |
1 |
362 |
cf |
[NAG]I:310 |
x,y,z |
1_555 |
6 |
1 |
362 |
67.6 |
1.1 |
0.079 |
1 |
0 |
0 |
0.000 |
| 28 |
35 |
|
[NAG]B:201 |
5 |
1 |
363 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
10366 |
64.3 |
1.8 |
0.586 |
0 |
0 |
0 |
0.000 |
| 29 |
36 |
|
[NAG]E:302 |
10 |
1 |
360 |
cf |
[NAG]E:301 |
x,y,z |
1_555 |
5 |
1 |
362 |
61.8 |
1.1 |
0.062 |
0 |
0 |
0 |
0.000 |
37 |
|
[NAG]I:302 |
10 |
1 |
361 |
cf |
[NAG]I:301 |
x,y,z |
1_555 |
5 |
1 |
362 |
61.7 |
1.1 |
0.059 |
0 |
0 |
0 |
0.000 |
| Average: |
61.8 |
1.1 |
0.061 |
0 |
0 |
0 |
0.000 |
| 30 |
38 |
|
[BMA]E:303 |
7 |
1 |
293 |
cf |
[NAG]E:302 |
x,y,z |
1_555 |
5 |
1 |
360 |
61.5 |
1.4 |
0.113 |
0 |
0 |
0 |
0.000 |
39 |
|
[BMA]I:303 |
5 |
1 |
293 |
cf |
[NAG]I:302 |
x,y,z |
1_555 |
5 |
1 |
361 |
60.9 |
1.4 |
0.156 |
0 |
0 |
0 |
0.000 |
| Average: |
61.2 |
1.4 |
0.134 |
0 |
0 |
0 |
0.000 |
| 31 |
40 |
|
[BMA]D:303 |
6 |
1 |
293 |
cf |
[NAG]D:302 |
x,y,z |
1_555 |
8 |
1 |
358 |
61.5 |
1.9 |
0.115 |
0 |
0 |
0 |
0.000 |
| 32 |
41 |
|
[BMA]I:306 |
6 |
1 |
288 |
cf |
[NAG]I:305 |
x,y,z |
1_555 |
6 |
1 |
359 |
60.9 |
0.8 |
0.104 |
0 |
0 |
0 |
0.000 |
| 33 |
42 |
|
[NAG]E:302 |
5 |
1 |
360 |
f |
E |
x,y,z |
1_555 |
7 |
4 |
11946 |
57.4 |
1.7 |
0.481 |
0 |
0 |
0 |
0.000 |
43 |
|
[NAG]I:302 |
5 |
1 |
361 |
f |
I |
x,y,z |
1_555 |
6 |
2 |
11740 |
53.2 |
1.5 |
0.453 |
0 |
0 |
0 |
0.000 |
| Average: |
55.3 |
1.6 |
0.467 |
0 |
0 |
0 |
0.000 |
| 34 |
44 |
|
I |
5 |
3 |
11740 |
◊ |
A |
x-1,y,z |
1_455 |
9 |
6 |
10366 |
57.2 |
2.0 |
0.874 |
0 |
0 |
0 |
0.000 |
| 35 |
45 |
|
[MAN]I:307 |
4 |
1 |
292 |
cf |
[BMA]I:306 |
x,y,z |
1_555 |
4 |
1 |
288 |
57.1 |
2.8 |
0.436 |
0 |
0 |
0 |
0.000 |
| 36 |
46 |
|
[NAG]I:311 |
5 |
1 |
362 |
f |
I |
x,y,z |
1_555 |
9 |
5 |
11740 |
56.7 |
1.1 |
0.390 |
0 |
0 |
0 |
0.000 |
| 37 |
47 |
|
[MAN]I:308 |
6 |
1 |
292 |
cf |
[BMA]I:306 |
x,y,z |
1_555 |
4 |
1 |
288 |
56.3 |
2.3 |
0.290 |
0 |
0 |
0 |
0.000 |
| 38 |
48 |
|
[NAG]E:306 |
5 |
1 |
363 |
f |
E |
x,y,z |
1_555 |
10 |
6 |
11946 |
53.3 |
0.9 |
0.351 |
0 |
0 |
0 |
0.000 |
| 39 |
49 |
|
[MAN]I:309 |
6 |
1 |
293 |
cf |
[MAN]I:307 |
x,y,z |
1_555 |
3 |
1 |
292 |
53.0 |
2.3 |
0.312 |
0 |
0 |
0 |
0.000 |
| 40 |
50 |
|
[NAG]C:302 |
4 |
1 |
364 |
f |
C |
x,y,z |
1_555 |
7 |
3 |
11744 |
36.5 |
1.3 |
0.521 |
0 |
0 |
0 |
0.000 |
| 41 |
51 |
|
[NAG]I:305 |
6 |
1 |
359 |
f |
I |
x,y,z |
1_555 |
5 |
2 |
11740 |
36.4 |
0.6 |
0.266 |
0 |
0 |
0 |
0.000 |
| 42 |
52 |
|
E |
5 |
2 |
11946 |
◊ |
[NAG]E:307 |
x-1,y,z |
1_455 |
3 |
1 |
363 |
34.9 |
1.6 |
0.525 |
0 |
0 |
0 |
0.000 |
| 43 |
53 |
|
[NAG]E:306 |
3 |
1 |
363 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
10256 |
30.9 |
0.7 |
0.437 |
0 |
0 |
0 |
0.000 |
| 44 |
54 |
|
E |
4 |
1 |
11946 |
◊ |
[BMA]E:303 |
x-1,y,z |
1_455 |
2 |
1 |
293 |
23.6 |
0.6 |
0.446 |
1 |
0 |
0 |
0.000 |
| 45 |
55 |
|
[NAG]I:311 |
5 |
1 |
362 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
10366 |
22.2 |
0.6 |
0.341 |
0 |
0 |
0 |
0.000 |
| 46 |
56 |
|
[NAG]C:302 |
4 |
1 |
364 |
◊ |
D |
-x-1/2,-y,z-1/2 |
2_454 |
2 |
1 |
11640 |
20.1 |
0.3 |
0.223 |
0 |
0 |
0 |
0.000 |
| 47 |
57 |
|
[NAG]D:302 |
4 |
1 |
358 |
f |
D |
x,y,z |
1_555 |
3 |
1 |
11640 |
16.7 |
0.2 |
0.288 |
0 |
0 |
0 |
0.000 |
| 48 |
58 |
|
E |
1 |
1 |
11946 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
10366 |
13.5 |
0.5 |
0.780 |
0 |
0 |
0 |
0.000 |
59 |
|
I |
1 |
1 |
11740 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
10256 |
1.3 |
0.1 |
0.736 |
0 |
0 |
0 |
0.000 |
| Average: |
7.4 |
0.3 |
0.758 |
0 |
0 |
0 |
0.000 |
| 49 |
60 |
|
[MAN]I:307 |
3 |
1 |
292 |
f |
[NAG]I:305 |
x,y,z |
1_555 |
1 |
1 |
359 |
10.7 |
0.5 |
0.243 |
0 |
0 |
0 |
0.000 |
| 50 |
61 |
|
E |
1 |
1 |
11946 |
◊ |
[NAG]E:302 |
x-1,y,z |
1_455 |
3 |
1 |
360 |
8.1 |
0.2 |
0.422 |
0 |
0 |
0 |
0.000 |
| 51 |
62 |
|
C |
2 |
1 |
11744 |
◊ |
[NAG]D:302 |
-x-1/2,-y,z-1/2 |
2_454 |
3 |
1 |
358 |
7.6 |
0.1 |
0.303 |
0 |
0 |
0 |
0.000 |
| 52 |
63 |
|
[MAN]I:308 |
1 |
1 |
292 |
f |
[NAG]I:305 |
x,y,z |
1_555 |
1 |
1 |
359 |
3.8 |
0.0 |
0.161 |
0 |
0 |
0 |
0.000 |
| 53 |
64 |
|
[MAN]I:309 |
1 |
1 |
293 |
f |
[BMA]I:306 |
x,y,z |
1_555 |
1 |
1 |
288 |
0.9 |
0.0 |
0.182 |
0 |
0 |
0 |
0.000 |
|