| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
G |
264 |
67 |
24752 |
◊ |
B |
x,y,z |
1_555 |
290 |
76 |
11356 |
2824.9 |
-44.8 |
0.016 |
23 |
8 |
1 |
1.000 |
2 |
|
L |
220 |
59 |
12495 |
◊ |
H |
x,y,z |
1_555 |
212 |
56 |
13313 |
1957.7 |
-30.8 |
0.045 |
13 |
4 |
0 |
1.000 |
3 |
|
E |
195 |
56 |
11930 |
◊ |
D |
x,y,z |
1_555 |
167 |
51 |
13096 |
1671.4 |
-28.8 |
0.033 |
8 |
2 |
0 |
1.000 |
4 |
|
B |
106 |
33 |
11356 |
x |
B |
z,x,y |
5_555 |
92 |
28 |
11356 |
1023.3 |
-15.2 |
0.369 |
4 |
4 |
0 |
1.000 |
5 |
|
G |
61 |
17 |
24752 |
x |
G |
z,x,y |
5_555 |
31 |
9 |
24752 |
430.7 |
-3.2 |
0.358 |
6 |
0 |
0 |
0.093 |
6 |
|
D |
32 |
8 |
13096 |
◊ |
B |
x,y,z |
1_555 |
44 |
14 |
11356 |
344.5 |
-2.3 |
0.476 |
6 |
0 |
0 |
0.137 |
7 |
|
E |
45 |
15 |
11930 |
◊ |
B |
-x+1,y,-z+1 |
3_656 |
26 |
8 |
11356 |
329.0 |
-7.0 |
0.179 |
1 |
0 |
0 |
0.206 |
8 |
|
H |
37 |
13 |
13313 |
◊ |
E |
-x+1,-y+2,z |
2_675 |
39 |
8 |
11930 |
311.1 |
-0.9 |
0.678 |
3 |
0 |
0 |
0.000 |
9 |
|
H |
29 |
7 |
13313 |
◊ |
G |
x,y,z |
1_555 |
40 |
10 |
24752 |
297.8 |
-2.6 |
0.239 |
2 |
3 |
0 |
0.315 |
10 |
|
G |
23 |
7 |
24752 |
◊ |
D |
x,y,z |
1_555 |
38 |
10 |
13096 |
269.3 |
-1.2 |
0.599 |
2 |
0 |
0 |
0.037 |
11 |
|
L |
28 |
9 |
12495 |
◊ |
G |
x,y,z |
1_555 |
29 |
8 |
24752 |
264.9 |
-0.2 |
0.662 |
7 |
0 |
0 |
0.263 |
12 |
|
L |
26 |
10 |
12495 |
◊ |
L |
-x+2,-y+2,z |
2_775 |
27 |
10 |
12495 |
233.1 |
-3.5 |
0.331 |
2 |
0 |
0 |
0.000 |
13 |
|
B |
24 |
5 |
11356 |
◊ |
G |
z,x,y |
5_555 |
25 |
8 |
24752 |
207.7 |
-1.4 |
0.521 |
2 |
1 |
0 |
0.039 |
14 |
|
D |
26 |
8 |
13096 |
◊ |
D |
-x+1,y,-z+1 |
3_656 |
23 |
8 |
13096 |
192.2 |
-0.0 |
0.766 |
4 |
0 |
0 |
0.025 |
15 |
|
[MAN]G:630 |
10 |
1 |
290 |
◊ |
L |
x,y,z |
1_555 |
17 |
7 |
12495 |
126.8 |
2.6 |
0.343 |
3 |
0 |
0 |
0.000 |
16 |
|
E |
11 |
5 |
11930 |
◊ |
E |
-x+1,y,-z+1 |
3_656 |
11 |
5 |
11930 |
92.6 |
0.6 |
0.820 |
2 |
0 |
0 |
0.005 |
17 |
|
[MAN]G:626 |
7 |
1 |
286 |
◊ |
L |
x,y,z |
1_555 |
12 |
3 |
12495 |
86.8 |
1.6 |
0.361 |
0 |
0 |
0 |
0.000 |
18 |
|
E |
10 |
3 |
11930 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
11356 |
86.6 |
-0.2 |
0.649 |
1 |
0 |
0 |
0.018 |
19 |
|
H |
9 |
5 |
13313 |
◊ |
H |
-x+2,y,-z+1 |
3_756 |
10 |
5 |
13313 |
85.0 |
-1.1 |
0.421 |
0 |
0 |
0 |
0.000 |
20 |
|
[BMA]D:303 |
7 |
1 |
291 |
f |
D |
x,y,z |
1_555 |
16 |
8 |
13096 |
83.4 |
1.3 |
0.381 |
1 |
0 |
0 |
0.000 |
21 |
|
[MAN]D:304 |
8 |
1 |
291 |
◊ |
E |
-x+1,y,-z+1 |
3_656 |
15 |
4 |
11930 |
75.0 |
0.3 |
0.211 |
0 |
0 |
0 |
0.000 |
22 |
|
[MAN]B:707 |
5 |
1 |
294 |
◊ |
D |
x,y,z |
1_555 |
10 |
6 |
13096 |
72.4 |
0.8 |
0.428 |
0 |
0 |
0 |
0.000 |
23 |
|
[BMA]G:625 |
7 |
1 |
288 |
◊ |
H |
x,y,z |
1_555 |
15 |
4 |
13313 |
68.6 |
2.1 |
0.475 |
0 |
0 |
0 |
0.000 |
24 |
|
[MAN]D:306 |
8 |
1 |
289 |
◊ |
D |
-x+1,y,-z+1 |
3_656 |
11 |
6 |
13096 |
68.4 |
1.3 |
0.350 |
0 |
0 |
0 |
0.000 |
25 |
|
[MAN]D:304 |
7 |
1 |
291 |
f |
D |
x,y,z |
1_555 |
9 |
3 |
13096 |
66.6 |
1.5 |
0.349 |
2 |
0 |
0 |
0.000 |
26 |
|
[MAN]G:608 |
7 |
1 |
291 |
cf |
[BMA]G:607 |
x,y,z |
1_555 |
6 |
1 |
291 |
65.8 |
2.5 |
0.171 |
0 |
0 |
0 |
0.000 |
27 |
|
[MAN]D:307 |
5 |
1 |
292 |
◊ |
E |
-x+1,y,-z+1 |
3_656 |
8 |
4 |
11930 |
64.2 |
0.4 |
0.268 |
0 |
0 |
0 |
0.000 |
28 |
|
[BMA]D:303 |
6 |
1 |
291 |
◊ |
E |
x,y,z |
1_555 |
11 |
2 |
11930 |
63.9 |
0.5 |
0.278 |
1 |
0 |
0 |
0.000 |
29 |
|
[MAN]G:626 |
7 |
1 |
286 |
◊ |
H |
x,y,z |
1_555 |
8 |
3 |
13313 |
63.6 |
1.9 |
0.390 |
0 |
0 |
0 |
0.000 |
30 |
|
[MAN]D:307 |
8 |
1 |
292 |
cf |
[MAN]D:305 |
x,y,z |
1_555 |
8 |
1 |
292 |
62.4 |
2.4 |
0.124 |
0 |
0 |
0 |
0.000 |
31 |
|
[BMA]B:704 |
4 |
1 |
286 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
13096 |
62.2 |
0.9 |
0.379 |
0 |
0 |
0 |
0.000 |
32 |
|
[MAN]G:628 |
7 |
1 |
292 |
cf |
[MAN]G:627 |
x,y,z |
1_555 |
5 |
1 |
291 |
60.7 |
2.8 |
0.223 |
0 |
0 |
0 |
0.000 |
33 |
|
[MAN]G:637 |
6 |
1 |
292 |
cf |
[BMA]G:636 |
x,y,z |
1_555 |
5 |
1 |
288 |
60.7 |
2.2 |
0.189 |
0 |
0 |
0 |
0.000 |
34 |
|
[MAN]B:706 |
6 |
1 |
291 |
cf |
[BMA]B:704 |
x,y,z |
1_555 |
6 |
1 |
286 |
60.4 |
2.4 |
0.211 |
0 |
0 |
0 |
0.000 |
35 |
|
[MAN]G:642 |
6 |
1 |
291 |
cf |
[BMA]G:640 |
x,y,z |
1_555 |
6 |
1 |
293 |
59.7 |
2.5 |
0.225 |
0 |
0 |
0 |
0.000 |
36 |
|
[MAN]G:630 |
6 |
1 |
290 |
cf |
[MAN]G:626 |
x,y,z |
1_555 |
6 |
1 |
286 |
59.4 |
2.8 |
0.214 |
0 |
0 |
0 |
0.000 |
37 |
|
[MAN]G:641 |
6 |
1 |
293 |
cf |
[BMA]G:640 |
x,y,z |
1_555 |
3 |
1 |
293 |
57.4 |
2.5 |
0.309 |
0 |
0 |
0 |
0.000 |
38 |
|
[MAN]B:707 |
5 |
1 |
294 |
cf |
[MAN]B:706 |
x,y,z |
1_555 |
6 |
1 |
291 |
57.4 |
2.6 |
0.252 |
0 |
0 |
0 |
0.000 |
39 |
|
[MAN]G:626 |
6 |
1 |
286 |
cf |
[BMA]G:625 |
x,y,z |
1_555 |
5 |
1 |
288 |
57.1 |
2.5 |
0.275 |
0 |
0 |
0 |
0.000 |
40 |
|
[MAN]B:705 |
6 |
1 |
292 |
cf |
[BMA]B:704 |
x,y,z |
1_555 |
4 |
1 |
286 |
56.5 |
2.5 |
0.266 |
0 |
0 |
0 |
0.000 |
41 |
|
[MAN]G:615 |
6 |
1 |
292 |
cf |
[BMA]G:614 |
x,y,z |
1_555 |
6 |
1 |
286 |
56.2 |
2.7 |
0.200 |
0 |
0 |
0 |
0.000 |
42 |
|
[MAN]G:627 |
6 |
1 |
291 |
cf |
[BMA]G:625 |
x,y,z |
1_555 |
5 |
1 |
288 |
55.7 |
2.4 |
0.239 |
0 |
0 |
0 |
0.000 |
43 |
|
[MAN]G:629 |
6 |
1 |
291 |
cf |
[MAN]G:627 |
x,y,z |
1_555 |
5 |
1 |
291 |
54.3 |
2.6 |
0.245 |
0 |
0 |
0 |
0.000 |
44 |
|
[MAN]D:304 |
7 |
1 |
291 |
cf |
[BMA]D:303 |
x,y,z |
1_555 |
5 |
1 |
291 |
53.2 |
2.3 |
0.184 |
0 |
0 |
0 |
0.000 |
45 |
|
[MAN]D:306 |
8 |
1 |
289 |
cf |
[MAN]D:305 |
x,y,z |
1_555 |
5 |
1 |
292 |
51.8 |
1.6 |
0.151 |
0 |
0 |
0 |
0.000 |
46 |
|
[MAN]D:305 |
7 |
1 |
292 |
cf |
[BMA]D:303 |
x,y,z |
1_555 |
6 |
1 |
291 |
50.6 |
2.2 |
0.187 |
0 |
0 |
0 |
0.000 |
47 |
|
[MAN]G:608 |
6 |
1 |
291 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
13096 |
48.8 |
0.1 |
0.241 |
0 |
0 |
0 |
0.000 |
48 |
|
[MAN]B:706 |
5 |
1 |
291 |
◊ |
D |
x,y,z |
1_555 |
7 |
4 |
13096 |
47.7 |
1.2 |
0.461 |
0 |
0 |
0 |
0.000 |
49 |
|
B |
4 |
2 |
11356 |
◊ |
E |
-z+1,-x+1,y |
7_665 |
4 |
1 |
11930 |
47.0 |
0.3 |
0.751 |
1 |
0 |
0 |
0.004 |
50 |
|
[MAN]D:306 |
7 |
1 |
289 |
f |
D |
x,y,z |
1_555 |
8 |
4 |
13096 |
45.6 |
0.3 |
0.182 |
1 |
0 |
0 |
0.027 |
51 |
|
[MAN]D:305 |
6 |
1 |
292 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
13096 |
44.8 |
-0.0 |
0.226 |
0 |
0 |
0 |
0.005 |
52 |
|
[MAN]D:304 |
5 |
1 |
291 |
◊ |
E |
x,y,z |
1_555 |
6 |
1 |
11930 |
44.8 |
1.2 |
0.389 |
0 |
0 |
0 |
0.000 |
53 |
|
[MAN]D:307 |
4 |
1 |
292 |
f |
D |
x,y,z |
1_555 |
5 |
2 |
13096 |
40.6 |
0.9 |
0.428 |
1 |
0 |
0 |
0.000 |
54 |
|
[MAN]D:306 |
5 |
1 |
289 |
◊ |
E |
-x+1,y,-z+1 |
3_656 |
12 |
3 |
11930 |
40.6 |
0.5 |
0.340 |
0 |
0 |
0 |
0.000 |
55 |
|
[MAN]G:629 |
4 |
1 |
291 |
◊ |
H |
x,y,z |
1_555 |
5 |
2 |
13313 |
40.1 |
0.5 |
0.339 |
0 |
0 |
0 |
0.000 |
56 |
|
[MAN]G:630 |
7 |
1 |
290 |
◊ |
H |
x,y,z |
1_555 |
4 |
1 |
13313 |
39.2 |
1.4 |
0.284 |
1 |
0 |
0 |
0.000 |
57 |
|
[MAN]D:306 |
7 |
1 |
289 |
◊ |
[MAN]D:306 |
-x+1,y,-z+1 |
3_656 |
7 |
1 |
289 |
38.5 |
1.3 |
0.118 |
0 |
0 |
0 |
0.000 |
58 |
|
[MAN]D:306 |
5 |
1 |
289 |
◊ |
E |
x,y,z |
1_555 |
7 |
2 |
11930 |
36.3 |
0.6 |
0.336 |
1 |
0 |
0 |
0.000 |
59 |
|
[MAN]G:630 |
4 |
1 |
290 |
f |
[BMA]G:625 |
x,y,z |
1_555 |
4 |
1 |
288 |
34.4 |
0.4 |
0.132 |
1 |
0 |
0 |
0.003 |
60 |
|
[MAN]B:706 |
2 |
1 |
291 |
f |
E |
x,y,z |
1_555 |
5 |
3 |
11930 |
34.2 |
0.5 |
0.451 |
0 |
0 |
0 |
0.000 |
61 |
|
[BMA]G:622 |
5 |
1 |
292 |
f |
L |
-x+2,-y+2,z |
2_775 |
5 |
3 |
12495 |
33.9 |
0.4 |
0.271 |
0 |
0 |
0 |
0.000 |
62 |
|
H |
5 |
2 |
13313 |
◊ |
D |
-x+1,-y+2,z |
2_675 |
2 |
1 |
13096 |
32.0 |
0.8 |
0.705 |
0 |
0 |
0 |
0.000 |
63 |
|
[MAN]D:305 |
3 |
1 |
292 |
◊ |
E |
-x+1,y,-z+1 |
3_656 |
4 |
2 |
11930 |
30.3 |
0.6 |
0.380 |
0 |
0 |
0 |
0.000 |
64 |
|
[MAN]D:307 |
4 |
1 |
292 |
◊ |
D |
-x+1,y,-z+1 |
3_656 |
3 |
1 |
13096 |
29.4 |
-0.3 |
0.154 |
0 |
0 |
0 |
0.009 |
65 |
|
[MAN]G:628 |
5 |
1 |
292 |
f |
[BMA]G:625 |
x,y,z |
1_555 |
5 |
1 |
288 |
28.2 |
0.6 |
0.109 |
0 |
0 |
0 |
0.000 |
66 |
|
[MAN]G:641 |
4 |
1 |
293 |
f |
G |
x,y,z |
1_555 |
2 |
2 |
24752 |
26.3 |
0.5 |
0.304 |
0 |
0 |
0 |
0.000 |
67 |
|
[MAN]D:305 |
4 |
1 |
292 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
11930 |
23.3 |
0.6 |
0.349 |
0 |
0 |
0 |
0.000 |
68 |
|
[MAN]G:629 |
3 |
1 |
291 |
f |
[BMA]G:625 |
x,y,z |
1_555 |
3 |
1 |
288 |
22.9 |
1.2 |
0.293 |
0 |
0 |
0 |
0.000 |
69 |
|
[MAN]B:707 |
2 |
1 |
294 |
f |
[BMA]B:704 |
x,y,z |
1_555 |
3 |
1 |
286 |
21.9 |
1.2 |
0.341 |
0 |
0 |
0 |
0.000 |
70 |
|
[MAN]D:305 |
4 |
1 |
292 |
◊ |
D |
-x+1,y,-z+1 |
3_656 |
2 |
1 |
13096 |
20.0 |
-0.1 |
0.187 |
0 |
0 |
0 |
0.004 |
71 |
|
[MAN]D:307 |
1 |
1 |
292 |
f |
[BMA]D:303 |
x,y,z |
1_555 |
1 |
1 |
291 |
11.2 |
0.5 |
0.340 |
0 |
0 |
0 |
0.000 |
72 |
|
[BMA]D:303 |
1 |
1 |
291 |
◊ |
E |
-x+1,y,-z+1 |
3_656 |
2 |
1 |
11930 |
8.5 |
-0.2 |
0.336 |
0 |
0 |
0 |
0.005 |
73 |
|
[MAN]D:306 |
2 |
1 |
289 |
f |
[BMA]D:303 |
x,y,z |
1_555 |
2 |
1 |
291 |
6.1 |
0.4 |
0.264 |
0 |
0 |
0 |
0.000 |
74 |
|
[MAN]G:608 |
1 |
1 |
291 |
f |
G |
x,y,z |
1_555 |
1 |
1 |
24752 |
5.9 |
0.1 |
0.381 |
0 |
0 |
0 |
0.000 |
75 |
|
[BMA]G:640 |
2 |
1 |
293 |
f |
G |
x,y,z |
1_555 |
1 |
1 |
24752 |
5.4 |
0.1 |
0.457 |
0 |
0 |
0 |
0.000 |
76 |
|
G |
3 |
1 |
24752 |
◊ |
B |
z,x,y |
5_555 |
1 |
1 |
11356 |
4.5 |
-0.1 |
0.522 |
0 |
0 |
0 |
0.001 |
77 |
|
[MAN]G:626 |
2 |
1 |
286 |
f |
G |
x,y,z |
1_555 |
1 |
1 |
24752 |
4.1 |
0.1 |
0.451 |
0 |
0 |
0 |
0.000 |
78 |
|
[MAN]D:307 |
1 |
1 |
292 |
f |
[MAN]D:306 |
x,y,z |
1_555 |
1 |
1 |
289 |
3.8 |
0.2 |
0.182 |
0 |
0 |
0 |
0.000 |
79 |
|
[MAN]D:305 |
1 |
1 |
292 |
f |
[MAN]D:304 |
x,y,z |
1_555 |
1 |
1 |
291 |
0.4 |
0.0 |
0.182 |
0 |
0 |
0 |
0.000 |
|