## |
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 |
|
A |
81 |
29 |
32130 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
69 |
23 |
32130 |
702.5 |
-2.4 |
0.547 |
4 |
3 |
0 |
0.000 |
2 |
|
[NKQ]A:1006 |
29 |
1 |
742 |
f |
A |
x,y,z |
1_555 |
74 |
28 |
32130 |
494.9 |
-9.1 |
0.185 |
7 |
0 |
0 |
0.013 |
3 |
|
A |
46 |
14 |
32130 |
x |
A |
x,y,z-1 |
1_554 |
46 |
17 |
32130 |
361.1 |
-4.9 |
0.207 |
2 |
1 |
0 |
0.000 |
4 |
|
A |
33 |
12 |
32130 |
x |
A |
x-1,y,z |
1_455 |
40 |
14 |
32130 |
294.4 |
-2.7 |
0.373 |
2 |
0 |
0 |
0.000 |
5 |
|
[NAG]A:900 |
13 |
1 |
363 |
cf |
A |
x,y,z |
1_555 |
30 |
12 |
32130 |
207.4 |
5.3 |
0.506 |
0 |
0 |
0 |
0.000 |
6 |
|
[NKQ]A:1007 |
8 |
1 |
313 |
f |
A |
x,y,z |
1_555 |
32 |
9 |
32130 |
188.7 |
-3.5 |
0.817 |
0 |
0 |
0 |
0.004 |
7 |
|
[NAG]A:907 |
9 |
1 |
360 |
cf |
A |
x,y,z |
1_555 |
19 |
8 |
32130 |
139.5 |
3.7 |
0.539 |
2 |
0 |
0 |
0.000 |
8 |
|
[EDO]A:1029 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
23 |
9 |
32130 |
126.2 |
3.4 |
0.579 |
1 |
0 |
0 |
0.000 |
9 |
|
[EDO]A:1013 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
24 |
9 |
32130 |
117.5 |
3.5 |
0.616 |
4 |
0 |
0 |
0.000 |
10 |
|
[EDO]A:1011 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
24 |
11 |
32130 |
116.7 |
4.1 |
0.685 |
5 |
0 |
0 |
0.000 |
11 |
|
[EDO]A:1019 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
32130 |
116.5 |
3.8 |
0.483 |
1 |
0 |
0 |
0.000 |
12 |
|
[EDO]A:1028 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
22 |
10 |
32130 |
115.6 |
4.0 |
0.665 |
4 |
0 |
0 |
0.000 |
13 |
|
[SCN]A:1008 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
32130 |
114.5 |
-2.1 |
0.584 |
1 |
0 |
0 |
0.003 |
14 |
|
[EDO]A:1012 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
11 |
32130 |
113.9 |
3.9 |
0.661 |
0 |
0 |
0 |
0.000 |
15 |
|
[EDO]A:1024 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
21 |
6 |
32130 |
113.3 |
3.7 |
0.545 |
0 |
0 |
0 |
0.000 |
16 |
|
[K]A:1005 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
32130 |
112.3 |
-79.0 |
0.000 |
0 |
0 |
0 |
0.082 |
17 |
|
[SCN]A:1009 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
32130 |
110.3 |
-4.1 |
0.421 |
1 |
0 |
0 |
0.005 |
18 |
|
[EDO]A:1023 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
21 |
10 |
32130 |
110.2 |
3.8 |
0.480 |
1 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:1016 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
26 |
10 |
32130 |
108.3 |
2.6 |
0.381 |
0 |
0 |
0 |
0.000 |
20 |
|
[EDO]A:1026 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
20 |
6 |
32130 |
107.9 |
3.4 |
0.443 |
2 |
0 |
0 |
0.000 |
21 |
|
[EDO]A:1010 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
32130 |
106.2 |
3.7 |
0.489 |
5 |
0 |
0 |
0.000 |
22 |
|
[EDO]A:1020 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
32130 |
103.2 |
2.6 |
0.384 |
3 |
0 |
0 |
0.000 |
23 |
|
[EDO]A:1015 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
16 |
9 |
32130 |
102.2 |
3.3 |
0.431 |
2 |
0 |
0 |
0.000 |
24 |
|
[NAG]A:898 |
10 |
1 |
351 |
cf |
A |
x,y,z |
1_555 |
11 |
4 |
32130 |
101.5 |
2.2 |
0.314 |
0 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:1018 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
7 |
32130 |
92.6 |
2.9 |
0.492 |
2 |
0 |
0 |
0.000 |
26 |
|
[EDO]A:1027 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
17 |
5 |
32130 |
90.1 |
2.5 |
0.460 |
1 |
0 |
0 |
0.000 |
27 |
|
[EDO]A:1022 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
32130 |
87.7 |
2.0 |
0.239 |
1 |
0 |
0 |
0.000 |
28 |
|
[NAG]A:901 |
8 |
1 |
363 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
32130 |
82.8 |
1.4 |
0.290 |
0 |
0 |
0 |
0.000 |
29 |
|
[EDO]A:1025 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
32130 |
82.3 |
1.9 |
0.242 |
1 |
0 |
0 |
0.000 |
30 |
|
[EDO]A:1017 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
32130 |
82.2 |
1.3 |
0.218 |
1 |
0 |
0 |
0.000 |
31 |
|
[MAN]A:905 |
8 |
1 |
293 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
32130 |
82.0 |
2.5 |
0.490 |
1 |
0 |
0 |
0.000 |
32 |
|
[EDO]A:1030 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
6 |
32130 |
82.0 |
3.4 |
0.541 |
0 |
0 |
0 |
0.000 |
33 |
|
[EDO]A:1021 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
32130 |
81.3 |
3.0 |
0.323 |
2 |
0 |
0 |
0.000 |
34 |
|
[MAN]A:904 |
7 |
1 |
290 |
f |
A |
x,y,z |
1_555 |
19 |
12 |
32130 |
79.7 |
1.0 |
0.301 |
0 |
0 |
0 |
0.000 |
35 |
|
[NAG]A:908 |
9 |
1 |
358 |
cf |
[NAG]A:907 |
x,y,z |
1_555 |
6 |
1 |
360 |
79.1 |
2.4 |
0.150 |
2 |
0 |
0 |
0.000 |
36 |
|
[EDO]A:1014 |
4 |
1 |
184 |
f |
A |
-x+1,y-1/2,-z |
2_645 |
11 |
4 |
32130 |
77.5 |
1.6 |
0.232 |
3 |
0 |
0 |
0.000 |
37 |
|
[NAG]A:899 |
10 |
1 |
363 |
cf |
[NAG]A:898 |
x,y,z |
1_555 |
7 |
1 |
351 |
72.6 |
1.6 |
0.065 |
0 |
0 |
0 |
0.000 |
38 |
|
A |
8 |
2 |
32130 |
◊ |
[NAG]A:898 |
-x,y-1/2,-z+1 |
2_546 |
7 |
1 |
351 |
72.2 |
0.1 |
0.143 |
0 |
0 |
0 |
0.000 |
39 |
|
A |
9 |
3 |
32130 |
◊ |
[NAG]A:899 |
-x,y-1/2,-z+1 |
2_546 |
8 |
1 |
363 |
72.1 |
0.2 |
0.151 |
1 |
0 |
0 |
0.000 |
40 |
|
[NAG]A:901 |
10 |
1 |
363 |
cf |
[NAG]A:900 |
x,y,z |
1_555 |
7 |
1 |
363 |
68.0 |
1.5 |
0.075 |
0 |
0 |
0 |
0.000 |
41 |
|
[EDO]A:1014 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
32130 |
67.3 |
2.1 |
0.306 |
2 |
0 |
0 |
0.000 |
42 |
|
[NA]A:1004 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
32130 |
65.9 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.010 |
43 |
|
[BMA]A:902 |
6 |
1 |
290 |
cf |
[NAG]A:901 |
x,y,z |
1_555 |
6 |
1 |
363 |
62.0 |
1.5 |
0.139 |
1 |
0 |
0 |
0.000 |
44 |
|
[MAN]A:904 |
6 |
1 |
290 |
cf |
[MAN]A:903 |
x,y,z |
1_555 |
5 |
1 |
289 |
58.6 |
2.5 |
0.289 |
0 |
0 |
0 |
0.000 |
45 |
|
[MAN]A:905 |
6 |
1 |
293 |
cf |
[MAN]A:904 |
x,y,z |
1_555 |
6 |
1 |
290 |
55.9 |
2.4 |
0.228 |
0 |
0 |
0 |
0.000 |
46 |
|
[MAN]A:903 |
6 |
1 |
289 |
f |
[NAG]A:901 |
x,y,z |
1_555 |
5 |
1 |
363 |
53.4 |
1.6 |
0.163 |
0 |
0 |
0 |
0.000 |
47 |
|
[MAN]A:905 |
5 |
1 |
293 |
f |
[NAG]A:901 |
x,y,z |
1_555 |
8 |
1 |
363 |
51.9 |
1.6 |
0.121 |
1 |
0 |
0 |
0.000 |
48 |
|
[MAN]A:903 |
5 |
1 |
289 |
cf |
[BMA]A:902 |
x,y,z |
1_555 |
3 |
1 |
290 |
50.8 |
2.3 |
0.336 |
0 |
0 |
0 |
0.000 |
49 |
|
[EDO]A:1017 |
3 |
1 |
184 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
9 |
2 |
32130 |
48.2 |
1.2 |
0.261 |
0 |
0 |
0 |
0.000 |
50 |
|
[CA]A:1003 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
32130 |
43.8 |
-12.8 |
0.000 |
0 |
0 |
0 |
0.013 |
51 |
|
A |
5 |
3 |
32130 |
◊ |
[EDO]A:1022 |
x-1,y,z |
1_455 |
2 |
1 |
184 |
43.5 |
1.0 |
0.464 |
0 |
0 |
0 |
0.000 |
52 |
|
[EDO]A:1030 |
4 |
1 |
183 |
f |
[MAN]A:904 |
x,y,z |
1_555 |
5 |
1 |
290 |
40.2 |
1.2 |
0.391 |
1 |
0 |
0 |
0.000 |
53 |
|
[MAN]A:904 |
5 |
1 |
290 |
f |
[NAG]A:901 |
x,y,z |
1_555 |
5 |
1 |
363 |
38.6 |
2.1 |
0.281 |
0 |
0 |
0 |
0.000 |
54 |
|
A |
2 |
1 |
32130 |
f |
[EDO]A:1015 |
-x+1,y-1/2,-z |
2_645 |
3 |
1 |
183 |
36.1 |
1.5 |
0.990 |
2 |
0 |
0 |
0.000 |
55 |
|
[ZN]A:1002 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
4 |
32130 |
35.9 |
-25.9 |
0.000 |
0 |
0 |
0 |
0.027 |
56 |
|
[NAG]A:908 |
5 |
1 |
358 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
32130 |
34.0 |
0.2 |
0.238 |
1 |
0 |
0 |
0.000 |
57 |
|
[MAN]A:905 |
4 |
1 |
293 |
f |
[MAN]A:903 |
x,y,z |
1_555 |
4 |
1 |
289 |
31.6 |
1.3 |
0.239 |
0 |
0 |
0 |
0.000 |
58 |
|
[EDO]A:1030 |
3 |
1 |
183 |
f |
[MAN]A:905 |
x,y,z |
1_555 |
5 |
1 |
293 |
29.7 |
1.2 |
0.459 |
0 |
0 |
0 |
0.000 |
59 |
|
[NKQ]A:1006 |
4 |
1 |
742 |
f |
[ZN]A:1002 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.5 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.011 |
60 |
|
[MAN]A:905 |
2 |
1 |
293 |
f |
[BMA]A:902 |
x,y,z |
1_555 |
4 |
1 |
290 |
26.7 |
1.1 |
0.252 |
1 |
0 |
0 |
0.000 |
61 |
|
[NKQ]A:1006 |
5 |
1 |
742 |
f |
[ZN]A:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
24.9 |
-11.2 |
0.000 |
0 |
0 |
0 |
0.012 |
62 |
|
A |
3 |
1 |
32130 |
◊ |
[NAG]A:908 |
x-1,y,z |
1_455 |
2 |
1 |
358 |
19.6 |
0.8 |
0.559 |
0 |
0 |
0 |
0.000 |
63 |
|
A |
3 |
2 |
32130 |
x |
A |
-x+1,y-1/2,-z-1 |
2_644 |
3 |
1 |
32130 |
15.0 |
0.2 |
0.725 |
0 |
0 |
0 |
0.000 |
64 |
|
[MAN]A:903 |
2 |
1 |
289 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
32130 |
12.9 |
-0.1 |
0.360 |
0 |
0 |
0 |
0.000 |
65 |
|
[MAN]A:904 |
1 |
1 |
290 |
f |
[BMA]A:902 |
x,y,z |
1_555 |
1 |
1 |
290 |
12.1 |
0.5 |
0.340 |
0 |
0 |
0 |
0.000 |
66 |
|
[EDO]A:1029 |
1 |
1 |
184 |
f |
[EDO]A:1016 |
x,y,z |
1_555 |
2 |
1 |
185 |
10.6 |
0.4 |
1.000 |
0 |
0 |
0 |
0.000 |
67 |
|
[ZN]A:1002 |
1 |
1 |
98 |
f |
[ZN]A:1001 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.8 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.006 |
68 |
|
[MAN]A:905 |
3 |
1 |
293 |
f |
[NAG]A:900 |
x,y,z |
1_555 |
1 |
1 |
363 |
3.8 |
-0.3 |
0.113 |
0 |
0 |
0 |
0.000 |
69 |
|
[NKQ]A:1007 |
1 |
1 |
313 |
f |
[NKQ]A:1006 |
x,y,z |
1_555 |
1 |
1 |
742 |
3.6 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
70 |
|
[EDO]A:1022 |
1 |
1 |
184 |
f |
[NAG]A:907 |
x,y,z |
1_555 |
1 |
1 |
360 |
1.9 |
0.0 |
0.378 |
0 |
0 |
0 |
0.000 |
|