## |
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 |
164 |
44 |
14646 |
◊ |
A |
x,-y,-z |
4_555 |
172 |
53 |
14628 |
1578.8 |
-11.3 |
0.125 |
7 |
0 |
0 |
0.000 |
2 |
|
B |
170 |
53 |
14646 |
◊ |
A |
x,y,z |
1_555 |
167 |
44 |
14628 |
1578.6 |
-11.2 |
0.125 |
8 |
0 |
0 |
0.000 |
Average: |
1578.7 |
-11.3 |
0.125 |
8 |
0 |
0 |
0.000 |
2 |
3 |
|
B |
32 |
11 |
14646 |
◊ |
A |
-x+1/2,y-1/2,-z-1/2 |
7_544 |
31 |
11 |
14628 |
296.6 |
1.5 |
0.757 |
1 |
6 |
0 |
0.000 |
3 |
4 |
|
[ST1]B:471 |
17 |
1 |
374 |
f |
B |
x,y,z |
1_555 |
38 |
16 |
14646 |
252.2 |
4.3 |
0.611 |
3 |
0 |
0 |
0.000 |
5 |
|
[ST1]A:471 |
17 |
1 |
373 |
f |
A |
x,y,z |
1_555 |
38 |
16 |
14628 |
251.4 |
4.1 |
0.611 |
3 |
0 |
0 |
0.000 |
Average: |
251.8 |
4.2 |
0.611 |
3 |
0 |
0 |
0.000 |
4 |
6 |
|
[NAG]A:484 |
11 |
1 |
367 |
cf |
A |
x,y,z |
1_555 |
20 |
8 |
14628 |
145.3 |
4.5 |
0.497 |
1 |
0 |
0 |
0.000 |
7 |
|
[NAG]B:484 |
11 |
1 |
367 |
cf |
B |
x,y,z |
1_555 |
21 |
8 |
14646 |
144.6 |
4.4 |
0.477 |
1 |
0 |
0 |
0.000 |
Average: |
144.9 |
4.4 |
0.487 |
1 |
0 |
0 |
0.000 |
5 |
8 |
|
[NAG]B:474 |
12 |
1 |
367 |
cf |
B |
x,y,z |
1_555 |
19 |
5 |
14646 |
141.9 |
3.6 |
0.335 |
1 |
0 |
0 |
0.000 |
9 |
|
[NAG]A:474 |
12 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
19 |
5 |
14628 |
140.2 |
3.5 |
0.335 |
1 |
0 |
0 |
0.000 |
Average: |
141.0 |
3.5 |
0.335 |
1 |
0 |
0 |
0.000 |
6 |
10 |
|
[NAG]A:472 |
12 |
1 |
358 |
cf |
A |
x,y,z |
1_555 |
14 |
7 |
14628 |
128.1 |
3.0 |
0.324 |
0 |
0 |
0 |
0.000 |
11 |
|
[NAG]B:472 |
13 |
1 |
360 |
cf |
B |
x,y,z |
1_555 |
14 |
7 |
14646 |
127.4 |
3.0 |
0.258 |
0 |
0 |
0 |
0.000 |
Average: |
127.8 |
3.0 |
0.291 |
0 |
0 |
0 |
0.000 |
7 |
12 |
|
[NAG]A:479 |
7 |
1 |
359 |
cf |
[NAG]A:478 |
x,y,z |
1_555 |
11 |
1 |
379 |
101.0 |
3.2 |
0.143 |
1 |
0 |
0 |
0.000 |
13 |
|
[NAG]B:479 |
8 |
1 |
357 |
cf |
[NAG]B:478 |
x,y,z |
1_555 |
11 |
1 |
379 |
99.7 |
3.1 |
0.135 |
1 |
0 |
0 |
0.000 |
Average: |
100.4 |
3.2 |
0.139 |
1 |
0 |
0 |
0.000 |
8 |
14 |
|
[MAN]A:483 |
7 |
1 |
297 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
14646 |
89.6 |
0.6 |
0.185 |
0 |
0 |
0 |
0.000 |
15 |
|
[MAN]B:483 |
7 |
1 |
296 |
◊ |
A |
x,-y,-z |
4_555 |
11 |
5 |
14628 |
89.3 |
0.6 |
0.168 |
0 |
0 |
0 |
0.000 |
Average: |
89.4 |
0.6 |
0.176 |
0 |
0 |
0 |
0.000 |
9 |
16 |
|
[NAG]A:478 |
9 |
1 |
379 |
◊ |
B |
x,y,z |
1_555 |
14 |
5 |
14646 |
86.2 |
1.4 |
0.247 |
0 |
0 |
0 |
0.000 |
17 |
|
[NAG]B:478 |
9 |
1 |
379 |
◊ |
A |
x,-y,-z |
4_555 |
14 |
5 |
14628 |
84.7 |
1.4 |
0.258 |
0 |
0 |
0 |
0.000 |
Average: |
85.5 |
1.4 |
0.252 |
0 |
0 |
0 |
0.000 |
10 |
18 |
|
[NAG]B:478 |
8 |
1 |
379 |
cf |
B |
x,y,z |
1_555 |
9 |
2 |
14646 |
82.7 |
1.8 |
0.378 |
1 |
0 |
0 |
0.000 |
19 |
|
[NAG]A:478 |
8 |
1 |
379 |
cf |
A |
x,y,z |
1_555 |
8 |
2 |
14628 |
82.3 |
1.8 |
0.358 |
1 |
0 |
0 |
0.000 |
Average: |
82.5 |
1.8 |
0.368 |
1 |
0 |
0 |
0.000 |
11 |
20 |
|
[BMA]A:476 |
7 |
1 |
287 |
cf |
[NAG]A:475 |
x,y,z |
1_555 |
8 |
1 |
360 |
78.7 |
1.9 |
0.114 |
0 |
0 |
0 |
0.000 |
21 |
|
[BMA]B:476 |
7 |
1 |
287 |
cf |
[NAG]B:475 |
x,y,z |
1_555 |
8 |
1 |
358 |
77.4 |
1.9 |
0.127 |
0 |
0 |
0 |
0.000 |
Average: |
78.0 |
1.9 |
0.121 |
0 |
0 |
0 |
0.000 |
12 |
22 |
|
[MAN]A:481 |
6 |
1 |
294 |
c |
[FUL]A:477 |
-x+1,y,-z-1/2 |
3_654 |
8 |
1 |
281 |
78.0 |
3.0 |
0.188 |
0 |
0 |
0 |
0.000 |
13 |
23 |
|
[NAG]B:473 |
9 |
1 |
352 |
cf |
[NAG]B:472 |
x,y,z |
1_555 |
6 |
1 |
360 |
76.0 |
1.2 |
0.081 |
0 |
0 |
0 |
0.000 |
24 |
|
[NAG]A:473 |
9 |
1 |
353 |
cf |
[NAG]A:472 |
x,y,z |
1_555 |
6 |
1 |
358 |
75.4 |
1.2 |
0.084 |
0 |
0 |
0 |
0.000 |
Average: |
75.7 |
1.2 |
0.083 |
0 |
0 |
0 |
0.000 |
14 |
25 |
|
[NAG]B:475 |
8 |
1 |
358 |
cf |
[NAG]B:474 |
x,y,z |
1_555 |
5 |
1 |
367 |
72.0 |
1.7 |
0.120 |
0 |
0 |
0 |
0.000 |
26 |
|
[NAG]A:475 |
8 |
1 |
360 |
cf |
[NAG]A:474 |
x,y,z |
1_555 |
6 |
1 |
364 |
71.3 |
1.7 |
0.111 |
0 |
0 |
0 |
0.000 |
Average: |
71.7 |
1.7 |
0.116 |
0 |
0 |
0 |
0.000 |
15 |
27 |
|
[NAG]A:485 |
9 |
1 |
356 |
cf |
[NAG]A:484 |
x,y,z |
1_555 |
6 |
1 |
367 |
71.4 |
1.9 |
0.104 |
1 |
0 |
0 |
0.000 |
28 |
|
[NAG]B:485 |
8 |
1 |
355 |
cf |
[NAG]B:484 |
x,y,z |
1_555 |
6 |
1 |
367 |
71.1 |
1.9 |
0.122 |
1 |
0 |
0 |
0.000 |
Average: |
71.3 |
1.9 |
0.113 |
1 |
0 |
0 |
0.000 |
16 |
29 |
|
[MAN]A:483 |
5 |
1 |
297 |
f |
[NAG]A:479 |
x,y,z |
1_555 |
7 |
1 |
359 |
65.7 |
1.4 |
0.165 |
0 |
0 |
0 |
0.000 |
30 |
|
[MAN]B:483 |
4 |
1 |
296 |
f |
[NAG]B:479 |
x,y,z |
1_555 |
7 |
1 |
357 |
65.7 |
1.3 |
0.172 |
0 |
0 |
0 |
0.000 |
Average: |
65.7 |
1.3 |
0.169 |
0 |
0 |
0 |
0.000 |
17 |
31 |
|
[MAN]A:481 |
7 |
1 |
294 |
cf |
[BMA]A:480 |
x,y,z |
1_555 |
6 |
1 |
293 |
61.7 |
2.4 |
0.182 |
0 |
0 |
0 |
0.000 |
32 |
|
[MAN]B:481 |
7 |
1 |
294 |
cf |
[BMA]B:480 |
x,y,z |
1_555 |
6 |
1 |
291 |
61.7 |
2.4 |
0.176 |
0 |
0 |
0 |
0.000 |
Average: |
61.7 |
2.4 |
0.179 |
0 |
0 |
0 |
0.000 |
18 |
33 |
|
[BMA]A:480 |
6 |
1 |
293 |
cf |
[NAG]A:479 |
x,y,z |
1_555 |
5 |
1 |
359 |
60.1 |
1.4 |
0.161 |
0 |
0 |
0 |
0.000 |
34 |
|
[BMA]B:480 |
5 |
1 |
291 |
cf |
[NAG]B:479 |
x,y,z |
1_555 |
5 |
1 |
357 |
59.8 |
1.4 |
0.171 |
0 |
0 |
0 |
0.000 |
Average: |
60.0 |
1.4 |
0.166 |
0 |
0 |
0 |
0.000 |
19 |
35 |
|
[FUC]B:477 |
5 |
1 |
282 |
cf |
[NAG]B:474 |
x,y,z |
1_555 |
6 |
1 |
367 |
59.3 |
1.4 |
0.111 |
0 |
0 |
0 |
0.000 |
20 |
36 |
|
[NAG]A:485 |
5 |
1 |
356 |
f |
[NAG]A:472 |
x,y,z |
1_555 |
6 |
1 |
358 |
56.7 |
3.0 |
0.352 |
0 |
0 |
0 |
0.000 |
37 |
|
[NAG]B:485 |
5 |
1 |
355 |
f |
[NAG]B:472 |
x,y,z |
1_555 |
6 |
1 |
360 |
56.1 |
3.0 |
0.330 |
0 |
0 |
0 |
0.000 |
Average: |
56.4 |
3.0 |
0.341 |
0 |
0 |
0 |
0.000 |
21 |
38 |
|
[FUL]A:477 |
5 |
1 |
281 |
cf |
[NAG]A:474 |
x,y,z |
1_555 |
6 |
1 |
364 |
56.1 |
1.4 |
0.132 |
0 |
0 |
0 |
0.000 |
22 |
39 |
|
[MAN]A:482 |
5 |
1 |
292 |
cf |
[MAN]A:481 |
x,y,z |
1_555 |
4 |
1 |
294 |
50.3 |
2.5 |
0.345 |
0 |
0 |
0 |
0.000 |
40 |
|
[MAN]B:482 |
5 |
1 |
290 |
cf |
[MAN]B:481 |
x,y,z |
1_555 |
4 |
1 |
294 |
50.0 |
2.5 |
0.352 |
0 |
0 |
0 |
0.000 |
Average: |
50.1 |
2.5 |
0.349 |
0 |
0 |
0 |
0.000 |
23 |
41 |
|
[MAN]B:483 |
5 |
1 |
296 |
cf |
[NAG]B:478 |
x,y,z |
1_555 |
3 |
1 |
379 |
49.2 |
1.7 |
0.293 |
0 |
0 |
0 |
0.000 |
42 |
|
[MAN]A:483 |
5 |
1 |
297 |
cf |
[NAG]A:478 |
x,y,z |
1_555 |
3 |
1 |
379 |
49.2 |
1.7 |
0.291 |
0 |
0 |
0 |
0.000 |
Average: |
49.2 |
1.7 |
0.292 |
0 |
0 |
0 |
0.000 |
24 |
43 |
|
[MAN]A:482 |
5 |
1 |
292 |
◊ |
B |
-x+1,y,-z-1/2 |
3_654 |
11 |
5 |
14646 |
48.8 |
1.2 |
0.419 |
0 |
0 |
0 |
0.000 |
25 |
44 |
|
B |
5 |
3 |
14646 |
◊ |
B |
-x+1,y,-z-1/2 |
3_654 |
5 |
3 |
14646 |
48.0 |
1.2 |
0.886 |
1 |
0 |
0 |
0.000 |
26 |
45 |
|
[MAN]B:483 |
2 |
1 |
296 |
f |
[BMA]B:480 |
x,y,z |
1_555 |
6 |
1 |
291 |
45.6 |
1.7 |
0.310 |
0 |
0 |
0 |
0.000 |
46 |
|
[MAN]A:483 |
2 |
1 |
297 |
f |
[BMA]A:480 |
x,y,z |
1_555 |
6 |
1 |
293 |
45.4 |
1.7 |
0.310 |
0 |
0 |
0 |
0.000 |
Average: |
45.5 |
1.7 |
0.310 |
0 |
0 |
0 |
0.000 |
27 |
47 |
|
[NAG]A:484 |
8 |
1 |
367 |
f |
[NAG]A:472 |
x,y,z |
1_555 |
6 |
1 |
358 |
43.2 |
1.4 |
0.096 |
0 |
0 |
0 |
0.000 |
48 |
|
[NAG]B:484 |
8 |
1 |
367 |
f |
[NAG]B:472 |
x,y,z |
1_555 |
6 |
1 |
360 |
42.7 |
1.4 |
0.089 |
0 |
0 |
0 |
0.000 |
Average: |
43.0 |
1.4 |
0.092 |
0 |
0 |
0 |
0.000 |
28 |
49 |
|
[NAG]B:475 |
5 |
1 |
358 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
14646 |
40.0 |
0.3 |
0.124 |
0 |
0 |
0 |
0.000 |
50 |
|
[NAG]A:475 |
5 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
14628 |
39.9 |
0.3 |
0.124 |
0 |
0 |
0 |
0.000 |
Average: |
40.0 |
0.3 |
0.124 |
0 |
0 |
0 |
0.000 |
29 |
51 |
|
[NAG]A:479 |
4 |
1 |
359 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
14646 |
39.4 |
0.9 |
0.304 |
0 |
0 |
0 |
0.000 |
52 |
|
[NAG]B:479 |
4 |
1 |
357 |
◊ |
A |
x,-y,-z |
4_555 |
5 |
2 |
14628 |
38.9 |
0.9 |
0.283 |
0 |
0 |
0 |
0.000 |
Average: |
39.1 |
0.9 |
0.294 |
0 |
0 |
0 |
0.000 |
30 |
53 |
|
[FUC]B:477 |
4 |
1 |
282 |
◊ |
A |
x,-y,-z |
4_555 |
4 |
2 |
14628 |
35.2 |
-0.3 |
0.167 |
0 |
0 |
0 |
0.000 |
31 |
54 |
|
[MAN]A:481 |
3 |
1 |
294 |
◊ |
[NAG]A:474 |
-x+1,y,-z-1/2 |
3_654 |
2 |
1 |
364 |
35.0 |
1.2 |
0.420 |
1 |
0 |
0 |
0.000 |
32 |
55 |
|
[MAN]A:482 |
4 |
1 |
292 |
◊ |
[FUL]A:477 |
-x+1,y,-z-1/2 |
3_654 |
3 |
1 |
281 |
34.8 |
0.9 |
0.196 |
0 |
0 |
0 |
0.000 |
33 |
56 |
|
[FUL]A:477 |
4 |
1 |
281 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
14646 |
33.0 |
-0.3 |
0.170 |
0 |
0 |
0 |
0.000 |
34 |
57 |
|
[MAN]A:482 |
4 |
1 |
292 |
f |
[BMA]A:480 |
x,y,z |
1_555 |
3 |
1 |
293 |
32.1 |
0.7 |
0.208 |
0 |
0 |
0 |
0.000 |
58 |
|
[MAN]B:482 |
4 |
1 |
290 |
f |
[BMA]B:480 |
x,y,z |
1_555 |
3 |
1 |
291 |
31.8 |
0.7 |
0.198 |
0 |
0 |
0 |
0.000 |
Average: |
32.0 |
0.7 |
0.203 |
0 |
0 |
0 |
0.000 |
35 |
59 |
|
[NAG]A:473 |
5 |
1 |
353 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
14628 |
30.9 |
1.0 |
0.357 |
0 |
0 |
0 |
0.000 |
60 |
|
[NAG]B:473 |
5 |
1 |
352 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
14646 |
30.6 |
1.0 |
0.356 |
0 |
0 |
0 |
0.000 |
Average: |
30.8 |
1.0 |
0.357 |
0 |
0 |
0 |
0.000 |
36 |
61 |
|
[FUC]B:477 |
3 |
1 |
282 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
14646 |
30.7 |
0.8 |
0.472 |
0 |
0 |
0 |
0.000 |
37 |
62 |
|
[FUL]A:477 |
3 |
1 |
281 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
14628 |
28.8 |
0.7 |
0.471 |
0 |
0 |
0 |
0.000 |
38 |
63 |
|
[FUC]B:477 |
1 |
1 |
282 |
f |
[BMA]B:476 |
x,y,z |
1_555 |
2 |
1 |
287 |
26.1 |
1.4 |
0.481 |
0 |
0 |
0 |
0.000 |
39 |
64 |
|
[MAN]A:481 |
3 |
1 |
294 |
f |
[NAG]A:479 |
x,y,z |
1_555 |
3 |
1 |
359 |
25.3 |
1.4 |
0.321 |
0 |
0 |
0 |
0.000 |
65 |
|
[MAN]B:481 |
3 |
1 |
294 |
f |
[NAG]B:479 |
x,y,z |
1_555 |
3 |
1 |
357 |
24.8 |
1.4 |
0.321 |
0 |
0 |
0 |
0.000 |
Average: |
25.1 |
1.4 |
0.321 |
0 |
0 |
0 |
0.000 |
40 |
66 |
|
[FUC]B:477 |
3 |
1 |
282 |
f |
[NAG]B:475 |
x,y,z |
1_555 |
5 |
1 |
358 |
24.9 |
0.8 |
0.142 |
0 |
0 |
0 |
0.000 |
41 |
67 |
|
[MAN]B:483 |
4 |
1 |
296 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
14646 |
24.7 |
1.0 |
0.494 |
0 |
0 |
0 |
0.000 |
68 |
|
[MAN]A:483 |
4 |
1 |
297 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
14628 |
24.3 |
1.0 |
0.468 |
0 |
0 |
0 |
0.000 |
Average: |
24.5 |
1.0 |
0.481 |
0 |
0 |
0 |
0.000 |
42 |
69 |
|
[FUL]A:477 |
1 |
1 |
281 |
f |
[BMA]A:476 |
x,y,z |
1_555 |
2 |
1 |
287 |
24.5 |
1.3 |
0.467 |
0 |
0 |
0 |
0.000 |
43 |
70 |
|
[FUL]A:477 |
3 |
1 |
281 |
f |
[NAG]A:475 |
x,y,z |
1_555 |
5 |
1 |
360 |
23.0 |
0.7 |
0.137 |
0 |
0 |
0 |
0.000 |
44 |
71 |
|
[FUL]A:477 |
5 |
1 |
281 |
◊ |
[BMA]A:480 |
-x+1,y,-z-1/2 |
3_654 |
4 |
1 |
293 |
20.9 |
1.0 |
0.154 |
0 |
0 |
0 |
0.000 |
45 |
72 |
|
[NAG]A:485 |
1 |
1 |
356 |
f |
[NAG]A:473 |
x,y,z |
1_555 |
4 |
1 |
353 |
16.9 |
0.5 |
0.251 |
0 |
0 |
0 |
0.000 |
73 |
|
[NAG]B:485 |
1 |
1 |
355 |
f |
[NAG]B:473 |
x,y,z |
1_555 |
4 |
1 |
352 |
16.8 |
0.4 |
0.251 |
0 |
0 |
0 |
0.000 |
Average: |
16.8 |
0.4 |
0.251 |
0 |
0 |
0 |
0.000 |
46 |
74 |
|
[MAN]A:481 |
1 |
1 |
294 |
◊ |
[BMA]A:476 |
-x+1,y,-z-1/2 |
3_654 |
1 |
1 |
287 |
12.1 |
0.8 |
0.589 |
0 |
0 |
0 |
0.000 |
47 |
75 |
|
[MAN]A:481 |
2 |
1 |
294 |
◊ |
A |
-x+1,y,-z-1/2 |
3_654 |
1 |
1 |
14628 |
7.9 |
0.3 |
0.472 |
0 |
0 |
0 |
0.000 |
48 |
76 |
|
[NAG]B:479 |
2 |
1 |
357 |
f |
B |
x,y,z |
1_555 |
3 |
2 |
14646 |
7.4 |
0.3 |
0.378 |
0 |
0 |
0 |
0.000 |
77 |
|
[NAG]A:479 |
2 |
1 |
359 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
14628 |
7.3 |
0.3 |
0.375 |
0 |
0 |
0 |
0.000 |
Average: |
7.3 |
0.3 |
0.377 |
0 |
0 |
0 |
0.000 |
49 |
78 |
|
[MAN]A:481 |
2 |
1 |
294 |
◊ |
[NAG]A:475 |
-x+1,y,-z-1/2 |
3_654 |
2 |
1 |
360 |
6.8 |
0.3 |
0.246 |
0 |
0 |
0 |
0.000 |
50 |
79 |
|
[NAG]A:473 |
2 |
1 |
353 |
◊ |
[MAN]B:482 |
x-1/2,y+1/2,z |
5_455 |
1 |
1 |
290 |
5.3 |
-0.0 |
0.197 |
0 |
0 |
0 |
0.000 |
51 |
80 |
|
[NAG]B:485 |
1 |
1 |
355 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
14646 |
4.6 |
0.2 |
0.579 |
0 |
0 |
0 |
0.000 |
81 |
|
[NAG]A:485 |
1 |
1 |
356 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
14628 |
4.2 |
0.2 |
0.528 |
0 |
0 |
0 |
0.000 |
Average: |
4.4 |
0.2 |
0.553 |
0 |
0 |
0 |
0.000 |
52 |
82 |
|
[BMA]A:476 |
1 |
1 |
287 |
◊ |
[NAG]A:479 |
-x+1,y,-z-1/2 |
3_654 |
1 |
1 |
359 |
3.5 |
0.2 |
0.237 |
0 |
0 |
0 |
0.000 |
|