## |
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 |
216 |
65 |
31564 |
◊ |
A |
x,y,z |
1_555 |
219 |
68 |
31611 |
2002.0 |
-8.2 |
0.260 |
20 |
5 |
0 |
0.000 |
2 |
2 |
|
B |
120 |
48 |
31564 |
◊ |
A |
x-1,y,z |
1_455 |
128 |
49 |
31611 |
1025.8 |
14.2 |
0.986 |
14 |
6 |
0 |
0.000 |
3 |
3 |
|
[HB2]A:915 |
20 |
1 |
505 |
f |
B |
x,y,z |
1_555 |
44 |
14 |
31564 |
260.2 |
-6.1 |
0.302 |
0 |
0 |
0 |
0.000 |
4 |
|
[HB2]B:901 |
20 |
1 |
510 |
f |
A |
x,y,z |
1_555 |
44 |
14 |
31611 |
241.5 |
-5.6 |
0.312 |
0 |
0 |
0 |
0.000 |
Average: |
250.8 |
-5.9 |
0.307 |
0 |
0 |
0 |
0.000 |
4 |
5 |
|
B |
30 |
9 |
31564 |
◊ |
A |
-x-1,y-1/2,-z |
2_445 |
32 |
10 |
31611 |
256.0 |
-0.4 |
0.511 |
7 |
0 |
0 |
0.000 |
5 |
6 |
|
[NAG]B:903 |
14 |
1 |
355 |
cf |
B |
x,y,z |
1_555 |
31 |
16 |
31564 |
221.8 |
5.1 |
0.396 |
3 |
0 |
0 |
0.000 |
7 |
|
[NAG]A:901 |
14 |
1 |
358 |
cf |
A |
x,y,z |
1_555 |
32 |
16 |
31611 |
220.8 |
4.7 |
0.379 |
3 |
0 |
0 |
0.000 |
Average: |
221.3 |
4.9 |
0.387 |
3 |
0 |
0 |
0.000 |
6 |
8 |
|
[NAG]A:906 |
14 |
1 |
355 |
cf |
A |
x,y,z |
1_555 |
30 |
17 |
31611 |
217.0 |
6.4 |
0.551 |
3 |
0 |
0 |
0.000 |
9 |
|
[NAG]B:908 |
13 |
1 |
357 |
cf |
B |
x,y,z |
1_555 |
30 |
17 |
31564 |
211.3 |
5.5 |
0.488 |
4 |
0 |
0 |
0.000 |
Average: |
214.2 |
6.0 |
0.520 |
4 |
0 |
0 |
0.000 |
7 |
10 |
|
A |
26 |
10 |
31611 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
21 |
8 |
31611 |
205.2 |
1.7 |
0.722 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
[NAG]B:913 |
13 |
1 |
360 |
cf |
B |
x,y,z |
1_555 |
25 |
15 |
31564 |
188.8 |
5.6 |
0.471 |
4 |
0 |
0 |
0.000 |
12 |
|
[NAG]A:910 |
13 |
1 |
359 |
cf |
A |
x,y,z |
1_555 |
26 |
15 |
31611 |
184.3 |
5.4 |
0.457 |
4 |
0 |
0 |
0.000 |
Average: |
186.5 |
5.5 |
0.464 |
4 |
0 |
0 |
0.000 |
9 |
13 |
|
[NAG]A:902 |
13 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
25 |
8 |
31611 |
165.0 |
4.0 |
0.367 |
2 |
0 |
0 |
0.000 |
14 |
|
[NAG]B:904 |
13 |
1 |
352 |
f |
B |
x,y,z |
1_555 |
22 |
8 |
31564 |
164.4 |
4.3 |
0.378 |
1 |
0 |
0 |
0.000 |
Average: |
164.7 |
4.2 |
0.372 |
2 |
0 |
0 |
0.000 |
10 |
15 |
|
[HB2]A:915 |
19 |
1 |
505 |
◊ |
A |
x,y,z |
1_555 |
19 |
7 |
31611 |
157.1 |
-0.3 |
0.701 |
3 |
0 |
0 |
0.000 |
16 |
|
[HB2]B:901 |
17 |
1 |
510 |
◊ |
B |
x,y,z |
1_555 |
16 |
7 |
31564 |
140.6 |
0.1 |
0.773 |
3 |
0 |
0 |
0.000 |
Average: |
148.8 |
-0.1 |
0.737 |
3 |
0 |
0 |
0.000 |
11 |
17 |
|
B |
18 |
5 |
31564 |
x |
B |
-x-1,y-1/2,-z |
2_445 |
22 |
9 |
31564 |
153.9 |
2.1 |
0.730 |
4 |
3 |
0 |
0.000 |
12 |
18 |
|
B |
21 |
7 |
31564 |
◊ |
[NAG]B:911 |
-x-1,y-1/2,-z |
2_445 |
13 |
1 |
363 |
140.2 |
2.5 |
0.213 |
4 |
0 |
0 |
0.000 |
13 |
19 |
|
B |
16 |
7 |
31564 |
x |
B |
-x-1,y-1/2,-z+1 |
2_446 |
17 |
7 |
31564 |
138.3 |
-0.6 |
0.401 |
2 |
2 |
0 |
0.000 |
14 |
20 |
|
[NAG]B:917 |
13 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
16 |
6 |
31564 |
135.9 |
2.9 |
0.253 |
1 |
0 |
0 |
0.000 |
15 |
21 |
|
B |
17 |
7 |
31564 |
◊ |
[NAG]A:905 |
x-1,y,z |
1_455 |
12 |
1 |
362 |
135.3 |
2.3 |
0.242 |
2 |
0 |
0 |
0.000 |
22 |
|
[NAG]B:907 |
13 |
1 |
363 |
◊ |
A |
x-1,y,z |
1_455 |
21 |
8 |
31611 |
131.7 |
2.3 |
0.168 |
1 |
0 |
0 |
0.000 |
Average: |
133.5 |
2.3 |
0.205 |
2 |
0 |
0 |
0.000 |
16 |
23 |
|
[NAG]B:914 |
11 |
1 |
359 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
31564 |
130.6 |
3.9 |
0.422 |
3 |
0 |
0 |
0.000 |
24 |
|
[NAG]A:911 |
10 |
1 |
361 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
31611 |
128.6 |
3.7 |
0.494 |
3 |
0 |
0 |
0.000 |
Average: |
129.6 |
3.8 |
0.458 |
3 |
0 |
0 |
0.000 |
17 |
25 |
|
[NAG]B:907 |
11 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
14 |
5 |
31564 |
129.0 |
3.9 |
0.391 |
4 |
0 |
0 |
0.000 |
26 |
|
[NAG]A:905 |
11 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
14 |
5 |
31611 |
128.0 |
4.1 |
0.463 |
2 |
0 |
0 |
0.000 |
Average: |
128.5 |
4.0 |
0.427 |
3 |
0 |
0 |
0.000 |
18 |
27 |
|
[NAG]B:916 |
10 |
1 |
359 |
cf |
B |
x,y,z |
1_555 |
14 |
6 |
31564 |
128.3 |
2.2 |
0.278 |
0 |
0 |
0 |
0.000 |
28 |
|
[NAG]A:913 |
11 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
15 |
6 |
31611 |
128.1 |
2.4 |
0.260 |
1 |
0 |
0 |
0.000 |
Average: |
128.2 |
2.3 |
0.269 |
1 |
0 |
0 |
0.000 |
19 |
29 |
|
[NAG]B:902 |
10 |
1 |
360 |
cf |
B |
x,y,z |
1_555 |
18 |
7 |
31564 |
127.7 |
3.2 |
0.387 |
1 |
0 |
0 |
0.000 |
20 |
30 |
|
[NAG]A:909 |
11 |
1 |
355 |
cf |
A |
x,y,z |
1_555 |
16 |
6 |
31611 |
118.8 |
3.1 |
0.353 |
2 |
0 |
0 |
0.000 |
21 |
31 |
|
[NAG]B:916 |
10 |
1 |
359 |
◊ |
A |
x-1,y,z |
1_455 |
14 |
6 |
31611 |
114.4 |
3.5 |
0.378 |
1 |
0 |
0 |
0.000 |
32 |
|
B |
17 |
6 |
31564 |
◊ |
[NAG]A:913 |
x-1,y,z |
1_455 |
10 |
1 |
360 |
102.3 |
2.4 |
0.276 |
1 |
0 |
0 |
0.000 |
Average: |
108.3 |
2.9 |
0.327 |
1 |
0 |
0 |
0.000 |
22 |
33 |
|
[NAG]A:914 |
12 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
16 |
6 |
31611 |
113.5 |
2.6 |
0.273 |
1 |
0 |
0 |
0.000 |
23 |
34 |
|
[NAG]B:911 |
11 |
1 |
363 |
cf |
B |
x,y,z |
1_555 |
14 |
6 |
31564 |
108.0 |
2.8 |
0.341 |
0 |
0 |
0 |
0.000 |
24 |
35 |
|
[NAG]A:907 |
11 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
13 |
4 |
31611 |
96.9 |
2.6 |
0.284 |
0 |
0 |
0 |
0.000 |
25 |
36 |
|
[NAG]B:912 |
7 |
1 |
356 |
cf |
B |
x,y,z |
1_555 |
11 |
6 |
31564 |
94.5 |
3.1 |
0.510 |
1 |
0 |
0 |
0.000 |
26 |
37 |
|
[NAG]B:909 |
10 |
1 |
363 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
31564 |
92.7 |
1.5 |
0.204 |
0 |
0 |
0 |
0.000 |
27 |
38 |
|
[NAG]A:909 |
11 |
1 |
355 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
11 |
3 |
31611 |
85.1 |
0.4 |
0.130 |
1 |
0 |
0 |
0.000 |
28 |
39 |
|
[NAG]B:902 |
7 |
1 |
360 |
◊ |
A |
-x-1,y-1/2,-z |
2_445 |
12 |
5 |
31611 |
84.2 |
1.3 |
0.269 |
0 |
0 |
0 |
0.000 |
29 |
40 |
|
[NAG]A:907 |
10 |
1 |
363 |
cf |
[NAG]A:906 |
x,y,z |
1_555 |
7 |
1 |
355 |
75.9 |
1.9 |
0.081 |
0 |
0 |
0 |
0.000 |
41 |
|
[NAG]B:909 |
10 |
1 |
363 |
cf |
[NAG]B:908 |
x,y,z |
1_555 |
7 |
1 |
357 |
72.4 |
2.0 |
0.085 |
0 |
0 |
0 |
0.000 |
Average: |
74.1 |
1.9 |
0.083 |
0 |
0 |
0 |
0.000 |
30 |
42 |
|
[NAG]A:902 |
9 |
1 |
360 |
cf |
[NAG]A:901 |
x,y,z |
1_555 |
6 |
1 |
358 |
70.8 |
1.6 |
0.093 |
1 |
0 |
0 |
0.000 |
43 |
|
[NAG]B:904 |
9 |
1 |
352 |
cf |
[NAG]B:903 |
x,y,z |
1_555 |
6 |
1 |
355 |
69.2 |
1.9 |
0.095 |
0 |
0 |
0 |
0.000 |
Average: |
70.0 |
1.7 |
0.094 |
1 |
0 |
0 |
0.000 |
31 |
44 |
|
B |
6 |
2 |
31564 |
◊ |
[HB2]B:901 |
-x-1,y-1/2,-z |
2_445 |
13 |
1 |
510 |
69.6 |
-0.3 |
0.810 |
0 |
0 |
0 |
0.000 |
32 |
45 |
|
[NAG]A:911 |
10 |
1 |
361 |
cf |
[NAG]A:910 |
x,y,z |
1_555 |
6 |
1 |
359 |
66.8 |
1.4 |
0.082 |
0 |
0 |
0 |
0.000 |
46 |
|
[NAG]B:914 |
9 |
1 |
359 |
cf |
[NAG]B:913 |
x,y,z |
1_555 |
7 |
1 |
360 |
65.6 |
1.1 |
0.051 |
0 |
0 |
0 |
0.000 |
Average: |
66.2 |
1.2 |
0.066 |
0 |
0 |
0 |
0.000 |
33 |
47 |
|
[MAN]A:904 |
5 |
1 |
291 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
31611 |
63.4 |
1.3 |
0.442 |
1 |
0 |
0 |
0.000 |
34 |
48 |
|
B |
6 |
2 |
31564 |
◊ |
[NAG]B:912 |
-x-1,y-1/2,-z |
2_445 |
5 |
1 |
356 |
62.6 |
0.7 |
0.259 |
0 |
0 |
0 |
0.000 |
35 |
49 |
|
[BMA]A:912 |
5 |
1 |
292 |
cf |
[NAG]A:911 |
x,y,z |
1_555 |
5 |
1 |
361 |
61.6 |
1.9 |
0.206 |
0 |
0 |
0 |
0.000 |
36 |
50 |
|
[BMA]B:905 |
6 |
1 |
282 |
cf |
[NAG]B:904 |
x,y,z |
1_555 |
6 |
1 |
352 |
61.2 |
1.5 |
0.109 |
1 |
0 |
0 |
0.000 |
37 |
51 |
|
[BMA]A:908 |
7 |
1 |
290 |
cf |
[NAG]A:907 |
x,y,z |
1_555 |
4 |
1 |
363 |
60.5 |
1.2 |
0.130 |
0 |
0 |
0 |
0.000 |
52 |
|
[BMA]B:915 |
7 |
1 |
291 |
cf |
[NAG]B:914 |
x,y,z |
1_555 |
4 |
1 |
359 |
58.6 |
1.2 |
0.130 |
0 |
0 |
0 |
0.000 |
Average: |
59.6 |
1.2 |
0.130 |
0 |
0 |
0 |
0.000 |
38 |
53 |
|
[BMA]A:903 |
7 |
1 |
292 |
cf |
[NAG]A:902 |
x,y,z |
1_555 |
5 |
1 |
360 |
60.3 |
0.9 |
0.100 |
0 |
0 |
0 |
0.000 |
39 |
54 |
|
[MAN]B:906 |
5 |
1 |
289 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
31564 |
60.0 |
1.1 |
0.374 |
2 |
0 |
0 |
0.000 |
40 |
55 |
|
[BMA]B:910 |
5 |
1 |
294 |
cf |
[NAG]B:909 |
x,y,z |
1_555 |
5 |
1 |
363 |
60.0 |
1.4 |
0.150 |
0 |
0 |
0 |
0.000 |
41 |
56 |
|
[MAN]B:906 |
6 |
1 |
289 |
cf |
[BMA]B:905 |
x,y,z |
1_555 |
3 |
1 |
282 |
58.0 |
2.9 |
0.367 |
0 |
0 |
0 |
0.000 |
42 |
57 |
|
[MAN]A:904 |
6 |
1 |
291 |
cf |
[BMA]A:903 |
x,y,z |
1_555 |
6 |
1 |
292 |
57.9 |
2.6 |
0.229 |
0 |
0 |
0 |
0.000 |
43 |
58 |
|
B |
6 |
3 |
31564 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
3 |
1 |
31611 |
42.7 |
0.2 |
0.673 |
1 |
0 |
0 |
0.000 |
44 |
59 |
|
[BMA]A:903 |
5 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
31611 |
40.0 |
1.4 |
0.484 |
0 |
0 |
0 |
0.000 |
45 |
60 |
|
[BMA]B:905 |
5 |
1 |
282 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
31564 |
38.5 |
0.8 |
0.346 |
0 |
0 |
0 |
0.000 |
46 |
61 |
|
[BMA]A:912 |
5 |
1 |
292 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
31611 |
36.7 |
1.1 |
0.368 |
0 |
0 |
0 |
0.000 |
47 |
62 |
|
[BMA]B:915 |
5 |
1 |
291 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
31564 |
34.6 |
0.3 |
0.289 |
1 |
0 |
0 |
0.000 |
48 |
63 |
|
[NAG]A:907 |
2 |
1 |
363 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
31564 |
31.6 |
1.5 |
0.727 |
0 |
0 |
0 |
0.000 |
64 |
|
[NAG]B:909 |
1 |
1 |
363 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
31611 |
15.9 |
0.5 |
0.672 |
0 |
0 |
0 |
0.000 |
Average: |
23.8 |
1.0 |
0.699 |
0 |
0 |
0 |
0.000 |
49 |
65 |
|
[BMA]B:910 |
4 |
1 |
294 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
31564 |
27.8 |
0.1 |
0.183 |
0 |
0 |
0 |
0.000 |
50 |
66 |
|
[BMA]A:908 |
3 |
1 |
290 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
31611 |
16.2 |
0.5 |
0.430 |
0 |
0 |
0 |
0.000 |
51 |
67 |
|
A |
4 |
2 |
31611 |
x |
A |
-x,y-1/2,-z |
2_545 |
2 |
1 |
31611 |
8.3 |
-0.1 |
0.459 |
0 |
0 |
0 |
0.000 |
52 |
68 |
|
[MAN]A:904 |
2 |
1 |
291 |
f |
[NAG]A:902 |
x,y,z |
1_555 |
1 |
1 |
360 |
2.5 |
0.0 |
0.194 |
0 |
0 |
0 |
0.000 |
|