## |
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 |
|
A |
103 |
24 |
20191 |
◊ |
A |
y,x,-z+1 |
4_556 |
102 |
24 |
20191 |
971.5 |
-11.4 |
0.145 |
12 |
6 |
0 |
0.000 |
2 |
2 |
|
A |
95 |
32 |
20191 |
x |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
79 |
21 |
20191 |
746.8 |
-0.7 |
0.745 |
8 |
5 |
0 |
0.000 |
3 |
3 |
|
[MBT]A:612 |
20 |
1 |
488 |
f |
A |
x,y,z |
1_555 |
48 |
12 |
20191 |
249.1 |
-2.0 |
0.358 |
0 |
0 |
0 |
0.000 |
4 |
4 |
|
[PGE]A:625 |
10 |
1 |
305 |
f |
A |
x,y,z |
1_555 |
40 |
14 |
20191 |
203.0 |
3.4 |
0.285 |
2 |
0 |
0 |
0.000 |
5 |
5 |
|
[PEG]A:618 |
7 |
1 |
262 |
f |
A |
x,y,z |
1_555 |
23 |
9 |
20191 |
156.3 |
5.4 |
0.537 |
3 |
0 |
0 |
0.000 |
6 |
6 |
|
[PGE]A:629 |
8 |
1 |
336 |
◊ |
A |
x,y,z |
1_555 |
25 |
12 |
20191 |
155.3 |
4.5 |
0.506 |
2 |
0 |
0 |
0.000 |
7 |
7 |
|
[PEG]A:619 |
7 |
1 |
262 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
20191 |
138.7 |
2.8 |
0.329 |
3 |
0 |
0 |
0.000 |
8 |
8 |
|
[PGE]A:627 |
9 |
1 |
337 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
20191 |
136.9 |
3.8 |
0.252 |
4 |
0 |
0 |
0.000 |
9 |
9 |
|
[PGE]A:626 |
10 |
1 |
337 |
f |
A |
x,y,z |
1_555 |
21 |
5 |
20191 |
136.9 |
3.7 |
0.229 |
1 |
0 |
0 |
0.000 |
10 |
10 |
|
[PEG]A:617 |
7 |
1 |
262 |
f |
A |
x,y,z |
1_555 |
24 |
8 |
20191 |
133.7 |
3.3 |
0.405 |
0 |
0 |
0 |
0.000 |
11 |
11 |
|
[PGE]A:628 |
7 |
1 |
318 |
◊ |
A |
x,y,z |
1_555 |
20 |
8 |
20191 |
123.0 |
3.6 |
0.354 |
4 |
0 |
0 |
0.000 |
12 |
12 |
|
[PEG]A:613 |
7 |
1 |
261 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
20191 |
120.7 |
2.1 |
0.285 |
1 |
0 |
0 |
0.000 |
13 |
13 |
|
[PEG]A:615 |
7 |
1 |
258 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
20191 |
113.1 |
2.3 |
0.283 |
0 |
0 |
0 |
0.000 |
14 |
14 |
|
[PEG]A:616 |
7 |
1 |
256 |
◊ |
A |
x,y,z |
1_555 |
21 |
8 |
20191 |
111.4 |
2.3 |
0.292 |
3 |
0 |
0 |
0.000 |
15 |
15 |
|
[EDO]A:634 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
20191 |
108.6 |
3.4 |
0.541 |
2 |
0 |
0 |
0.000 |
16 |
16 |
|
[PGE]A:628 |
8 |
1 |
318 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
13 |
4 |
20191 |
104.3 |
2.2 |
0.205 |
1 |
0 |
0 |
0.000 |
17 |
17 |
|
[PEG]A:622 |
7 |
1 |
262 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
20191 |
102.6 |
1.2 |
0.197 |
2 |
0 |
0 |
0.000 |
18 |
18 |
|
[PEG]A:620 |
7 |
1 |
261 |
f |
A |
x,y,z |
1_555 |
9 |
4 |
20191 |
100.8 |
2.2 |
0.238 |
1 |
0 |
0 |
0.000 |
19 |
19 |
|
[NAG]A:601 |
10 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
10 |
4 |
20191 |
100.0 |
2.3 |
0.299 |
0 |
0 |
0 |
0.000 |
20 |
20 |
|
[PEG]A:614 |
6 |
1 |
258 |
f |
A |
x,y,z |
1_555 |
20 |
6 |
20191 |
99.0 |
1.7 |
0.311 |
2 |
0 |
0 |
0.000 |
21 |
21 |
|
[NAG]A:603 |
8 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
11 |
4 |
20191 |
99.0 |
3.1 |
0.523 |
0 |
0 |
0 |
0.000 |
22 |
22 |
|
[EDO]A:638 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
6 |
20191 |
96.0 |
2.5 |
0.447 |
0 |
0 |
0 |
0.000 |
23 |
23 |
|
A |
11 |
4 |
20191 |
◊ |
[PEG]A:621 |
-y+1,x-y+1,z+1/3 |
2_665 |
7 |
1 |
262 |
95.8 |
2.2 |
0.237 |
1 |
0 |
0 |
0.000 |
24 |
24 |
|
[EDO]A:631 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
20191 |
95.4 |
5.3 |
0.608 |
1 |
0 |
0 |
0.000 |
25 |
25 |
|
[NAG]A:607 |
7 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
10 |
4 |
20191 |
92.5 |
3.0 |
0.567 |
1 |
0 |
0 |
0.000 |
26 |
26 |
|
[PGE]A:629 |
9 |
1 |
336 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
12 |
5 |
20191 |
91.4 |
1.8 |
0.128 |
3 |
0 |
0 |
0.000 |
27 |
27 |
|
[EDO]A:636 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
20191 |
86.4 |
2.5 |
0.297 |
2 |
0 |
0 |
0.000 |
28 |
28 |
|
[EDO]A:630 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
20191 |
83.5 |
2.3 |
0.307 |
3 |
0 |
0 |
0.000 |
29 |
29 |
|
[PEG]A:624 |
6 |
1 |
263 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
20191 |
83.1 |
0.7 |
0.147 |
0 |
0 |
0 |
0.000 |
30 |
30 |
|
[EDO]A:632 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
17 |
8 |
20191 |
81.8 |
2.2 |
0.265 |
0 |
0 |
0 |
0.000 |
31 |
31 |
|
[PEG]A:623 |
6 |
1 |
258 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
20191 |
81.1 |
0.2 |
0.124 |
1 |
0 |
0 |
0.000 |
32 |
32 |
|
[PEG]A:614 |
7 |
1 |
258 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
11 |
3 |
20191 |
81.1 |
1.7 |
0.254 |
1 |
0 |
0 |
0.000 |
33 |
33 |
|
[EDO]A:637 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
20191 |
77.9 |
2.2 |
0.240 |
1 |
0 |
0 |
0.000 |
34 |
34 |
|
A |
12 |
5 |
20191 |
◊ |
[PEG]A:624 |
-y+1,x-y+1,z+1/3 |
2_665 |
5 |
1 |
263 |
76.1 |
1.6 |
0.328 |
2 |
0 |
0 |
0.000 |
35 |
35 |
|
[NAG]A:608 |
9 |
1 |
364 |
cf |
[NAG]A:607 |
x,y,z |
1_555 |
7 |
1 |
363 |
72.3 |
1.6 |
0.083 |
0 |
0 |
0 |
0.000 |
36 |
|
[NAG]A:604 |
9 |
1 |
362 |
cf |
[NAG]A:603 |
x,y,z |
1_555 |
6 |
1 |
363 |
68.9 |
1.5 |
0.094 |
0 |
0 |
0 |
0.000 |
Average: |
70.6 |
1.6 |
0.088 |
0 |
0 |
0 |
0.000 |
36 |
37 |
|
[PEG]A:621 |
6 |
1 |
262 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
20191 |
71.7 |
3.1 |
0.398 |
0 |
0 |
0 |
0.000 |
37 |
38 |
|
[MBT]A:612 |
5 |
1 |
488 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
10 |
4 |
20191 |
70.7 |
-1.3 |
0.362 |
0 |
0 |
0 |
0.000 |
38 |
39 |
|
A |
6 |
3 |
20191 |
◊ |
[MAN]A:606 |
x-y,-y+1,-z+2/3 |
5_565 |
6 |
1 |
293 |
70.3 |
1.7 |
0.364 |
2 |
0 |
0 |
0.000 |
39 |
40 |
|
[EDO]A:633 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
20191 |
69.4 |
0.8 |
0.494 |
2 |
0 |
0 |
0.000 |
40 |
41 |
|
[MAN]A:610 |
7 |
1 |
291 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
11 |
5 |
20191 |
66.3 |
0.3 |
0.204 |
0 |
0 |
0 |
0.000 |
41 |
42 |
|
[EDO]A:635 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
20191 |
64.8 |
1.5 |
0.773 |
0 |
0 |
0 |
0.000 |
42 |
43 |
|
[MAN]A:611 |
7 |
1 |
291 |
◊ |
[NAG]A:603 |
-y+1,x-y+1,z+1/3 |
2_665 |
6 |
1 |
363 |
61.7 |
2.8 |
0.240 |
0 |
0 |
0 |
0.000 |
43 |
44 |
|
[MAN]A:606 |
6 |
1 |
293 |
cf |
[BMA]A:605 |
x,y,z |
1_555 |
6 |
1 |
294 |
61.1 |
2.7 |
0.229 |
0 |
0 |
0 |
0.000 |
44 |
45 |
|
[BMA]A:605 |
7 |
1 |
294 |
cf |
[NAG]A:604 |
x,y,z |
1_555 |
6 |
1 |
362 |
60.7 |
1.1 |
0.105 |
0 |
0 |
0 |
0.000 |
46 |
|
[BMA]A:609 |
7 |
1 |
291 |
cf |
[NAG]A:608 |
x,y,z |
1_555 |
5 |
1 |
364 |
59.7 |
1.1 |
0.109 |
0 |
0 |
0 |
0.000 |
Average: |
60.2 |
1.1 |
0.107 |
0 |
0 |
0 |
0.000 |
45 |
47 |
|
[MAN]A:610 |
6 |
1 |
291 |
cf |
[BMA]A:609 |
x,y,z |
1_555 |
5 |
1 |
291 |
59.7 |
2.6 |
0.280 |
0 |
0 |
0 |
0.000 |
46 |
48 |
|
[FUC]A:602 |
4 |
1 |
280 |
cf |
[NAG]A:601 |
x,y,z |
1_555 |
5 |
1 |
361 |
58.6 |
2.5 |
0.308 |
0 |
0 |
0 |
0.000 |
47 |
49 |
|
A |
10 |
4 |
20191 |
◊ |
[PEG]A:616 |
-y+1,x-y+1,z+1/3 |
2_665 |
4 |
1 |
256 |
57.1 |
2.3 |
0.579 |
0 |
0 |
0 |
0.000 |
48 |
50 |
|
[MAN]A:611 |
4 |
1 |
291 |
cf |
[MAN]A:610 |
x,y,z |
1_555 |
5 |
1 |
291 |
55.9 |
2.2 |
0.275 |
0 |
0 |
0 |
0.000 |
49 |
51 |
|
[PEG]A:614 |
5 |
1 |
258 |
f |
[MBT]A:612 |
x,y,z |
1_555 |
15 |
1 |
488 |
52.2 |
2.3 |
0.355 |
0 |
0 |
0 |
0.000 |
50 |
52 |
|
[PEG]A:621 |
5 |
1 |
262 |
f |
[PEG]A:616 |
x,y,z |
1_555 |
6 |
1 |
256 |
50.2 |
2.7 |
0.112 |
0 |
0 |
0 |
0.000 |
51 |
53 |
|
[PGE]A:629 |
5 |
1 |
336 |
◊ |
[MBT]A:612 |
x,y,z |
1_555 |
7 |
1 |
488 |
47.2 |
2.6 |
0.358 |
0 |
0 |
0 |
0.000 |
52 |
54 |
|
[PGE]A:626 |
4 |
1 |
337 |
f |
[NAG]A:601 |
x,y,z |
1_555 |
6 |
1 |
361 |
44.4 |
0.5 |
0.069 |
2 |
0 |
0 |
0.000 |
53 |
55 |
|
[PGE]A:625 |
3 |
1 |
305 |
f |
[MBT]A:612 |
x,y,z |
1_555 |
5 |
1 |
488 |
41.6 |
1.5 |
0.423 |
0 |
0 |
0 |
0.000 |
54 |
56 |
|
[MAN]A:611 |
2 |
1 |
291 |
◊ |
[NAG]A:604 |
-y+1,x-y+1,z+1/3 |
2_665 |
5 |
1 |
362 |
39.3 |
1.4 |
0.323 |
1 |
0 |
0 |
0.000 |
55 |
57 |
|
[EDO]A:637 |
4 |
1 |
185 |
f |
[PGE]A:626 |
x,y,z |
1_555 |
3 |
1 |
337 |
37.9 |
2.0 |
0.505 |
0 |
0 |
0 |
0.000 |
56 |
58 |
|
[MAN]A:611 |
4 |
1 |
291 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
5 |
4 |
20191 |
35.1 |
1.1 |
0.510 |
0 |
0 |
0 |
0.000 |
57 |
59 |
|
[PEG]A:622 |
3 |
1 |
262 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
5 |
1 |
20191 |
27.2 |
0.4 |
0.280 |
0 |
0 |
0 |
0.000 |
58 |
60 |
|
A |
5 |
2 |
20191 |
◊ |
A |
x-y+1,-y+2,-z+2/3 |
5_675 |
5 |
2 |
20191 |
27.2 |
0.2 |
0.687 |
0 |
0 |
0 |
0.000 |
59 |
61 |
|
[FUC]A:602 |
2 |
1 |
280 |
f |
A |
x,y,z |
1_555 |
4 |
3 |
20191 |
25.1 |
0.4 |
0.374 |
0 |
0 |
0 |
0.000 |
60 |
62 |
|
[EDO]A:635 |
2 |
1 |
186 |
f |
A |
y,x,-z+1 |
4_556 |
4 |
1 |
20191 |
24.9 |
0.6 |
0.839 |
0 |
0 |
0 |
0.000 |
61 |
63 |
|
[PGE]A:626 |
1 |
1 |
337 |
f |
[FUC]A:602 |
x,y,z |
1_555 |
4 |
1 |
280 |
24.2 |
-0.2 |
0.119 |
1 |
0 |
0 |
0.000 |
62 |
64 |
|
[EDO]A:631 |
2 |
1 |
186 |
f |
[PEG]A:613 |
x,y,z |
1_555 |
4 |
1 |
261 |
22.4 |
1.0 |
0.314 |
0 |
0 |
0 |
0.000 |
63 |
65 |
|
[MAN]A:606 |
3 |
1 |
293 |
f |
[NAG]A:604 |
x,y,z |
1_555 |
3 |
1 |
362 |
22.2 |
0.6 |
0.249 |
0 |
0 |
0 |
0.000 |
64 |
66 |
|
[EDO]A:630 |
1 |
1 |
185 |
f |
[PEG]A:618 |
x,y,z |
1_555 |
1 |
1 |
262 |
20.5 |
-0.2 |
0.378 |
1 |
0 |
0 |
0.000 |
65 |
67 |
|
A |
2 |
1 |
20191 |
◊ |
[NAG]A:603 |
-y+1,x-y+1,z+1/3 |
2_665 |
2 |
1 |
363 |
19.4 |
0.1 |
0.214 |
0 |
0 |
0 |
0.000 |
66 |
68 |
|
[MAN]A:611 |
1 |
1 |
291 |
f |
[BMA]A:609 |
x,y,z |
1_555 |
3 |
1 |
291 |
17.8 |
0.7 |
0.390 |
0 |
0 |
0 |
0.000 |
67 |
69 |
|
[MAN]A:610 |
3 |
1 |
291 |
f |
[NAG]A:608 |
x,y,z |
1_555 |
3 |
1 |
364 |
16.3 |
0.4 |
0.228 |
0 |
0 |
0 |
0.000 |
68 |
70 |
|
[PGE]A:628 |
2 |
1 |
318 |
f |
[PEG]A:616 |
-y+1,x-y+1,z+1/3 |
2_665 |
2 |
1 |
256 |
13.6 |
0.8 |
0.267 |
0 |
0 |
0 |
0.000 |
69 |
71 |
|
[PGE]A:629 |
2 |
1 |
336 |
◊ |
[PEG]A:614 |
x,y,z |
1_555 |
1 |
1 |
258 |
13.3 |
0.9 |
0.314 |
0 |
0 |
0 |
0.000 |
70 |
72 |
|
[PGE]A:628 |
2 |
1 |
318 |
f |
[PEG]A:621 |
-y+1,x-y+1,z+1/3 |
2_665 |
2 |
1 |
262 |
12.6 |
0.4 |
0.153 |
0 |
0 |
0 |
0.000 |
71 |
73 |
|
[MAN]A:610 |
1 |
1 |
291 |
◊ |
[NAG]A:603 |
-y+1,x-y+1,z+1/3 |
2_665 |
2 |
1 |
363 |
10.6 |
0.2 |
0.193 |
0 |
0 |
0 |
0.000 |
72 |
74 |
|
[PGE]A:628 |
1 |
1 |
318 |
f |
[EDO]A:632 |
-y+1,x-y+1,z+1/3 |
2_665 |
1 |
1 |
186 |
5.0 |
-0.1 |
0.316 |
0 |
0 |
0 |
0.000 |
73 |
75 |
|
A |
1 |
1 |
20191 |
◊ |
[BMA]A:609 |
y-1,x,-z+1 |
4_456 |
1 |
1 |
291 |
4.1 |
0.3 |
0.398 |
0 |
0 |
0 |
0.000 |
74 |
76 |
|
[PGE]A:629 |
1 |
1 |
336 |
f |
[PGE]A:628 |
x,y,z |
1_555 |
1 |
1 |
318 |
0.6 |
0.0 |
0.245 |
0 |
0 |
0 |
0.000 |
75 |
77 |
|
[BMA]A:609 |
1 |
1 |
291 |
◊ |
A |
-y+1,x-y+1,z+1/3 |
2_665 |
1 |
1 |
20191 |
0.1 |
0.0 |
0.338 |
0 |
0 |
0 |
0.000 |
|