| ## |
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 |
|
C |
234 |
61 |
31587 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
225 |
57 |
31257 |
2189.8 |
-16.3 |
0.144 |
44 |
7 |
0 |
0.000 |
2 |
|
B |
229 |
60 |
32074 |
◊ |
A |
x,y,z |
1_555 |
236 |
63 |
31326 |
2176.6 |
-17.7 |
0.117 |
45 |
8 |
0 |
0.000 |
| Average: |
2183.2 |
-17.0 |
0.131 |
45 |
8 |
0 |
0.000 |
| 2 |
3 |
|
C |
64 |
17 |
31587 |
◊ |
B |
x,y,z |
1_555 |
54 |
12 |
32074 |
541.1 |
2.1 |
0.759 |
8 |
6 |
0 |
0.000 |
| 3 |
4 |
|
A |
53 |
16 |
31326 |
◊ |
C |
x-1,y,z |
1_455 |
54 |
19 |
31587 |
471.1 |
2.4 |
0.687 |
4 |
1 |
0 |
0.000 |
| 4 |
5 |
|
A |
46 |
16 |
31326 |
◊ |
B |
x-1,y,z |
1_455 |
41 |
14 |
32074 |
396.4 |
1.1 |
0.746 |
4 |
2 |
0 |
0.000 |
| 5 |
6 |
|
[SY1]D:800 |
26 |
1 |
533 |
f |
D |
x,y,z |
1_555 |
54 |
16 |
31257 |
330.3 |
2.0 |
0.382 |
4 |
0 |
0 |
0.000 |
7 |
|
[SY1]C:800 |
26 |
1 |
533 |
f |
C |
x,y,z |
1_555 |
58 |
16 |
31587 |
328.4 |
1.9 |
0.405 |
4 |
0 |
0 |
0.000 |
8 |
|
[SY1]A:800 |
26 |
1 |
536 |
f |
A |
x,y,z |
1_555 |
53 |
17 |
31326 |
327.0 |
2.0 |
0.412 |
4 |
0 |
0 |
0.000 |
9 |
|
[SY1]B:800 |
26 |
1 |
529 |
f |
B |
x,y,z |
1_555 |
53 |
17 |
32074 |
323.2 |
2.2 |
0.403 |
4 |
0 |
0 |
0.000 |
| Average: |
327.2 |
2.0 |
0.400 |
4 |
0 |
0 |
0.000 |
| 6 |
10 |
|
B |
34 |
14 |
32074 |
◊ |
D |
x,y-1,z |
1_545 |
30 |
8 |
31257 |
309.0 |
1.1 |
0.617 |
3 |
0 |
0 |
0.000 |
| 7 |
11 |
|
[SY1]A:801 |
24 |
1 |
538 |
f |
A |
x,y,z |
1_555 |
39 |
12 |
31326 |
298.7 |
1.1 |
0.385 |
2 |
0 |
0 |
0.000 |
12 |
|
[SY1]D:801 |
24 |
1 |
537 |
f |
D |
x,y,z |
1_555 |
36 |
12 |
31257 |
298.5 |
1.8 |
0.434 |
3 |
0 |
0 |
0.000 |
13 |
|
[SY1]B:801 |
24 |
1 |
542 |
f |
B |
x,y,z |
1_555 |
35 |
12 |
32074 |
294.7 |
1.3 |
0.363 |
3 |
0 |
0 |
0.000 |
14 |
|
[SY1]C:801 |
24 |
1 |
543 |
f |
C |
x,y,z |
1_555 |
38 |
12 |
31587 |
291.0 |
1.1 |
0.360 |
2 |
0 |
0 |
0.000 |
| Average: |
295.7 |
1.3 |
0.386 |
3 |
0 |
0 |
0.000 |
| 8 |
15 |
|
B |
19 |
4 |
32074 |
x |
B |
-x,y-1/2,-z |
2_545 |
19 |
6 |
32074 |
191.1 |
0.9 |
0.727 |
3 |
0 |
0 |
0.000 |
| 9 |
16 |
|
B |
20 |
9 |
32074 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
20 |
5 |
31257 |
187.2 |
-1.9 |
0.308 |
0 |
0 |
0 |
0.000 |
| 10 |
17 |
|
[NAG]C:807 |
10 |
1 |
362 |
cf |
C |
x,y,z |
1_555 |
23 |
9 |
31587 |
168.4 |
3.7 |
0.451 |
1 |
0 |
0 |
0.000 |
| 11 |
18 |
|
[NAG]A:807 |
10 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
23 |
9 |
31326 |
162.6 |
3.6 |
0.458 |
0 |
0 |
0 |
0.000 |
| 12 |
19 |
|
[NAG]D:803 |
12 |
1 |
361 |
cf |
D |
x,y,z |
1_555 |
19 |
7 |
31257 |
160.8 |
4.4 |
0.471 |
1 |
0 |
0 |
0.000 |
20 |
|
[NAG]B:805 |
12 |
1 |
362 |
cf |
B |
x,y,z |
1_555 |
22 |
8 |
32074 |
156.9 |
3.8 |
0.400 |
1 |
0 |
0 |
0.000 |
| Average: |
158.8 |
4.1 |
0.435 |
1 |
0 |
0 |
0.000 |
| 13 |
21 |
|
[NAG]A:808 |
12 |
1 |
359 |
cf |
A |
x,y,z |
1_555 |
20 |
8 |
31326 |
157.0 |
4.4 |
0.483 |
1 |
0 |
0 |
0.000 |
22 |
|
[NAG]C:804 |
12 |
1 |
364 |
cf |
C |
x,y,z |
1_555 |
22 |
8 |
31587 |
156.5 |
4.0 |
0.430 |
0 |
0 |
0 |
0.000 |
| Average: |
156.8 |
4.2 |
0.457 |
1 |
0 |
0 |
0.000 |
| 14 |
23 |
|
[NAG]C:803 |
11 |
1 |
363 |
cf |
C |
x,y,z |
1_555 |
18 |
8 |
31587 |
136.8 |
3.5 |
0.409 |
0 |
0 |
0 |
0.000 |
| 15 |
24 |
|
[NAG]C:806 |
11 |
1 |
363 |
cf |
C |
x,y,z |
1_555 |
18 |
5 |
31587 |
128.9 |
3.8 |
0.440 |
1 |
0 |
0 |
0.000 |
| 16 |
25 |
|
[NAG]D:802 |
9 |
1 |
365 |
cf |
D |
x,y,z |
1_555 |
20 |
8 |
31257 |
127.7 |
4.9 |
0.630 |
0 |
0 |
0 |
0.000 |
| 17 |
26 |
|
[NAG]A:804 |
11 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
17 |
7 |
31326 |
126.2 |
3.3 |
0.401 |
1 |
0 |
0 |
0.000 |
| 18 |
27 |
|
[NAG]B:804 |
12 |
1 |
362 |
cf |
B |
x,y,z |
1_555 |
17 |
7 |
32074 |
125.6 |
3.5 |
0.364 |
1 |
0 |
0 |
0.000 |
| 19 |
28 |
|
[NAG]B:803 |
10 |
1 |
365 |
cf |
B |
x,y,z |
1_555 |
16 |
6 |
32074 |
124.4 |
4.3 |
0.522 |
1 |
0 |
0 |
0.000 |
29 |
|
[NAG]C:802 |
10 |
1 |
365 |
cf |
C |
x,y,z |
1_555 |
15 |
6 |
31587 |
122.7 |
4.5 |
0.551 |
0 |
0 |
0 |
0.000 |
30 |
|
[NAG]A:803 |
9 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
19 |
9 |
31326 |
117.3 |
4.1 |
0.561 |
0 |
0 |
0 |
0.000 |
| Average: |
121.5 |
4.3 |
0.544 |
0 |
0 |
0 |
0.000 |
| 20 |
31 |
|
D |
15 |
6 |
31257 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
32074 |
121.3 |
-0.2 |
0.406 |
1 |
0 |
0 |
0.000 |
| 21 |
32 |
|
[NAG]D:805 |
12 |
1 |
357 |
cf |
D |
x,y,z |
1_555 |
15 |
4 |
31257 |
115.2 |
2.8 |
0.271 |
2 |
0 |
0 |
0.000 |
33 |
|
[NAG]B:807 |
12 |
1 |
356 |
cf |
B |
x,y,z |
1_555 |
15 |
4 |
32074 |
108.8 |
2.7 |
0.242 |
1 |
0 |
0 |
0.000 |
| Average: |
112.0 |
2.7 |
0.257 |
2 |
0 |
0 |
0.000 |
| 22 |
34 |
|
A |
14 |
6 |
31326 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
10 |
4 |
31257 |
100.5 |
1.2 |
0.772 |
0 |
0 |
0 |
0.000 |
| 23 |
35 |
|
C |
11 |
6 |
31587 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
9 |
5 |
31326 |
95.7 |
1.0 |
0.758 |
1 |
1 |
0 |
0.000 |
| 24 |
36 |
|
[NAG]A:805 |
10 |
1 |
359 |
◊ |
A |
x,y,z |
1_555 |
17 |
4 |
31326 |
93.4 |
1.8 |
0.270 |
0 |
0 |
0 |
0.000 |
| 25 |
37 |
|
[NAG]A:802 |
9 |
1 |
359 |
cf |
A |
x,y,z |
1_555 |
13 |
5 |
31326 |
87.9 |
1.9 |
0.317 |
1 |
0 |
0 |
0.000 |
| 26 |
38 |
|
A |
10 |
5 |
31326 |
◊ |
C |
-x,y-1/2,-z |
2_545 |
7 |
2 |
31587 |
86.4 |
-1.4 |
0.247 |
0 |
0 |
0 |
0.000 |
| 27 |
39 |
|
[NAG]B:802 |
8 |
1 |
355 |
cf |
B |
x,y,z |
1_555 |
8 |
2 |
32074 |
84.4 |
1.7 |
0.345 |
0 |
0 |
0 |
0.000 |
| 28 |
40 |
|
D |
10 |
4 |
31257 |
x |
D |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
2 |
31257 |
83.9 |
-1.9 |
0.123 |
0 |
0 |
0 |
0.000 |
| 29 |
41 |
|
[NAG]B:806 |
10 |
1 |
363 |
cf |
[NAG]B:805 |
x,y,z |
1_555 |
6 |
1 |
362 |
76.0 |
1.9 |
0.093 |
0 |
0 |
0 |
0.000 |
| 30 |
42 |
|
[NAG]A:809 |
9 |
1 |
364 |
cf |
[NAG]A:808 |
x,y,z |
1_555 |
7 |
1 |
359 |
72.5 |
1.6 |
0.095 |
0 |
0 |
0 |
0.000 |
| 31 |
43 |
|
[NAG]D:804 |
8 |
1 |
363 |
cf |
[NAG]D:803 |
x,y,z |
1_555 |
6 |
1 |
361 |
71.8 |
1.7 |
0.101 |
0 |
0 |
0 |
0.000 |
44 |
|
[NAG]C:805 |
10 |
1 |
364 |
cf |
[NAG]C:804 |
x,y,z |
1_555 |
7 |
1 |
364 |
71.0 |
1.5 |
0.070 |
0 |
0 |
0 |
0.000 |
| Average: |
71.4 |
1.6 |
0.085 |
0 |
0 |
0 |
0.000 |
| 32 |
45 |
|
[NAG]A:806 |
8 |
1 |
362 |
cf |
[NAG]A:805 |
x,y,z |
1_555 |
6 |
1 |
359 |
66.0 |
1.6 |
0.107 |
0 |
0 |
0 |
0.000 |
| 33 |
46 |
|
[NAG]A:809 |
5 |
1 |
364 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
31326 |
50.8 |
1.1 |
0.321 |
0 |
0 |
0 |
0.000 |
| 34 |
47 |
|
[NAG]D:804 |
4 |
1 |
363 |
f |
D |
x,y,z |
1_555 |
4 |
2 |
31257 |
46.8 |
1.1 |
0.371 |
0 |
0 |
0 |
0.000 |
48 |
|
[NAG]B:806 |
2 |
1 |
363 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
32074 |
36.6 |
0.8 |
0.550 |
0 |
0 |
0 |
0.000 |
| Average: |
41.7 |
0.9 |
0.461 |
0 |
0 |
0 |
0.000 |
| 35 |
49 |
|
[NAG]C:805 |
4 |
1 |
364 |
f |
C |
x,y,z |
1_555 |
5 |
2 |
31587 |
46.1 |
1.0 |
0.406 |
0 |
0 |
0 |
0.000 |
| 36 |
50 |
|
[NAG]A:806 |
3 |
1 |
362 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
31326 |
44.3 |
1.1 |
0.515 |
0 |
0 |
0 |
0.000 |
| 37 |
51 |
|
A |
5 |
2 |
31326 |
◊ |
[NAG]B:802 |
x-1,y,z |
1_455 |
4 |
1 |
355 |
29.4 |
0.8 |
0.413 |
0 |
0 |
0 |
0.000 |
| 38 |
52 |
|
C |
3 |
1 |
31587 |
f |
[NAG]A:806 |
x,y,z-1 |
1_554 |
3 |
1 |
362 |
28.7 |
0.8 |
0.440 |
0 |
0 |
0 |
0.000 |
| 39 |
53 |
|
C |
3 |
2 |
31587 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
3 |
1 |
31257 |
22.7 |
-0.1 |
0.504 |
0 |
0 |
0 |
0.000 |
| 40 |
54 |
|
D |
3 |
1 |
31257 |
◊ |
[NAG]D:805 |
-x+1,y-1/2,-z+1 |
2_646 |
2 |
1 |
357 |
19.3 |
0.8 |
0.550 |
0 |
0 |
0 |
0.000 |
| 41 |
55 |
|
C |
1 |
1 |
31587 |
f |
[NAG]A:805 |
x,y,z-1 |
1_554 |
3 |
1 |
359 |
13.9 |
0.5 |
0.439 |
0 |
0 |
0 |
0.000 |
| 42 |
56 |
|
C |
1 |
1 |
31587 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
1 |
1 |
32074 |
0.5 |
0.0 |
0.665 |
0 |
0 |
0 |
0.000 |
| 43 |
57 |
|
B |
1 |
1 |
32074 |
◊ |
[NAG]D:804 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
363 |
0.4 |
-0.0 |
0.287 |
0 |
0 |
0 |
0.000 |
|