## |
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 |
92 |
30 |
31978 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
76 |
26 |
31978 |
753.2 |
-2.2 |
0.585 |
7 |
4 |
0 |
0.000 |
2 |
|
[DWW]A:937 |
23 |
1 |
566 |
f |
A |
x,y,z |
1_555 |
57 |
21 |
31978 |
395.7 |
-20.5 |
0.221 |
1 |
0 |
0 |
0.015 |
3 |
|
A |
49 |
16 |
31978 |
x |
A |
x,y,z-1 |
1_554 |
47 |
14 |
31978 |
388.4 |
-4.4 |
0.259 |
2 |
1 |
0 |
0.000 |
4 |
|
A |
34 |
13 |
31978 |
x |
A |
x-1,y,z |
1_455 |
40 |
14 |
31978 |
326.0 |
-1.5 |
0.489 |
3 |
1 |
0 |
0.000 |
5 |
|
[NAG]A:903 |
13 |
1 |
361 |
cf |
A |
x,y,z |
1_555 |
30 |
12 |
31978 |
207.3 |
5.4 |
0.534 |
1 |
0 |
0 |
0.000 |
6 |
|
[NAG]A:910 |
9 |
1 |
362 |
cf |
A |
x,y,z |
1_555 |
18 |
8 |
31978 |
136.4 |
3.6 |
0.535 |
2 |
0 |
0 |
0.000 |
7 |
|
[EDO]A:935 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
25 |
9 |
31978 |
121.4 |
3.2 |
0.560 |
0 |
0 |
0 |
0.000 |
8 |
|
[EDO]A:924 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
31978 |
118.3 |
3.4 |
0.593 |
3 |
0 |
0 |
0.000 |
9 |
|
[SCN]A:920 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
31978 |
117.8 |
-2.1 |
0.582 |
1 |
0 |
0 |
0.002 |
10 |
|
[EDO]A:930 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
31978 |
115.7 |
4.0 |
0.496 |
2 |
0 |
0 |
0.000 |
11 |
|
[EDO]A:934 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
24 |
10 |
31978 |
115.7 |
4.0 |
0.674 |
4 |
0 |
0 |
0.000 |
12 |
|
[EDO]A:923 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
11 |
31978 |
115.3 |
3.7 |
0.661 |
2 |
0 |
0 |
0.000 |
13 |
|
[EDO]A:922 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
31978 |
113.3 |
4.1 |
0.674 |
6 |
0 |
0 |
0.000 |
14 |
|
[SCN]A:918 |
3 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
31978 |
113.1 |
-3.9 |
0.437 |
0 |
0 |
0 |
0.003 |
15 |
|
[K]A:916 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
31978 |
111.8 |
-80.7 |
0.000 |
0 |
0 |
0 |
0.057 |
16 |
|
[SCN]A:919 |
3 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
31978 |
109.1 |
-4.3 |
0.411 |
1 |
0 |
0 |
0.003 |
17 |
|
[EDO]A:927 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
27 |
10 |
31978 |
108.9 |
2.6 |
0.382 |
0 |
0 |
0 |
0.000 |
18 |
|
[EDO]A:921 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
31978 |
106.3 |
3.8 |
0.501 |
6 |
0 |
0 |
0.000 |
19 |
|
[EDO]A:931 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
18 |
7 |
31978 |
106.0 |
2.5 |
0.418 |
3 |
0 |
0 |
0.000 |
20 |
|
[EDO]A:928 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
31978 |
103.9 |
2.7 |
0.432 |
4 |
0 |
0 |
0.000 |
21 |
|
[NAG]A:901 |
10 |
1 |
354 |
cf |
A |
x,y,z |
1_555 |
11 |
4 |
31978 |
99.9 |
2.1 |
0.295 |
0 |
0 |
0 |
0.000 |
22 |
|
[SO4]A:917 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
9 |
31978 |
98.4 |
-17.0 |
0.294 |
5 |
0 |
0 |
0.013 |
23 |
|
[EDO]A:929 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
31978 |
91.2 |
3.1 |
0.505 |
3 |
0 |
0 |
0.000 |
24 |
|
[EDO]A:926 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
9 |
31978 |
90.0 |
3.0 |
0.430 |
2 |
0 |
0 |
0.000 |
25 |
|
[EDO]A:933 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
13 |
4 |
31978 |
89.2 |
2.1 |
0.240 |
1 |
0 |
0 |
0.000 |
26 |
|
[NAG]A:904 |
8 |
1 |
362 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
31978 |
85.6 |
1.6 |
0.326 |
0 |
0 |
0 |
0.000 |
27 |
|
[EDO]A:932 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
31978 |
81.7 |
2.8 |
0.328 |
2 |
0 |
0 |
0.000 |
28 |
|
[NAG]A:911 |
9 |
1 |
360 |
cf |
[NAG]A:910 |
x,y,z |
1_555 |
7 |
1 |
362 |
81.4 |
2.6 |
0.141 |
1 |
0 |
0 |
0.000 |
29 |
|
[EDO]A:936 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
31978 |
81.2 |
3.6 |
0.540 |
0 |
0 |
0 |
0.000 |
30 |
|
[MAN]A:908 |
8 |
1 |
290 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
31978 |
81.1 |
2.4 |
0.479 |
1 |
0 |
0 |
0.000 |
31 |
|
[MAN]A:907 |
7 |
1 |
289 |
f |
A |
x,y,z |
1_555 |
19 |
12 |
31978 |
77.8 |
1.1 |
0.302 |
0 |
0 |
0 |
0.000 |
32 |
|
[EDO]A:925 |
4 |
1 |
185 |
f |
A |
-x+1,y-1/2,-z |
2_645 |
11 |
4 |
31978 |
75.1 |
1.5 |
0.664 |
3 |
0 |
0 |
0.000 |
33 |
|
[NAG]A:902 |
10 |
1 |
358 |
cf |
[NAG]A:901 |
x,y,z |
1_555 |
7 |
1 |
354 |
73.7 |
1.8 |
0.071 |
0 |
0 |
0 |
0.000 |
34 |
|
A |
8 |
2 |
31978 |
◊ |
[NAG]A:901 |
-x,y-1/2,-z+1 |
2_546 |
8 |
1 |
354 |
71.5 |
0.1 |
0.121 |
0 |
0 |
0 |
0.000 |
35 |
|
[EDO]A:925 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
31978 |
67.2 |
2.0 |
0.828 |
2 |
0 |
0 |
0.000 |
36 |
|
[NAG]A:904 |
9 |
1 |
362 |
cf |
[NAG]A:903 |
x,y,z |
1_555 |
6 |
1 |
361 |
66.8 |
1.5 |
0.095 |
0 |
0 |
0 |
0.000 |
37 |
|
[NA]A:915 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
31978 |
66.1 |
-10.1 |
0.000 |
0 |
0 |
0 |
0.007 |
38 |
|
A |
10 |
3 |
31978 |
◊ |
[NAG]A:902 |
-x,y-1/2,-z+1 |
2_546 |
8 |
1 |
358 |
65.6 |
0.2 |
0.167 |
2 |
0 |
0 |
0.000 |
39 |
|
[BMA]A:905 |
7 |
1 |
291 |
cf |
[NAG]A:904 |
x,y,z |
1_555 |
6 |
1 |
362 |
60.5 |
1.5 |
0.113 |
1 |
0 |
0 |
0.000 |
40 |
|
[MAN]A:908 |
7 |
1 |
290 |
cf |
[MAN]A:907 |
x,y,z |
1_555 |
6 |
1 |
289 |
57.9 |
2.5 |
0.215 |
0 |
0 |
0 |
0.000 |
41 |
|
[MAN]A:907 |
6 |
1 |
289 |
cf |
[MAN]A:906 |
x,y,z |
1_555 |
5 |
1 |
290 |
57.1 |
2.3 |
0.270 |
0 |
0 |
0 |
0.000 |
42 |
|
[MAN]A:909 |
5 |
1 |
289 |
cf |
[BMA]A:905 |
x,y,z |
1_555 |
5 |
1 |
291 |
55.1 |
2.5 |
0.252 |
0 |
0 |
0 |
0.000 |
43 |
|
[MAN]A:906 |
6 |
1 |
290 |
f |
[NAG]A:904 |
x,y,z |
1_555 |
5 |
1 |
362 |
52.8 |
1.5 |
0.169 |
0 |
0 |
0 |
0.000 |
44 |
|
[MAN]A:908 |
5 |
1 |
290 |
f |
[NAG]A:904 |
x,y,z |
1_555 |
7 |
1 |
362 |
51.4 |
1.6 |
0.171 |
1 |
0 |
0 |
0.000 |
45 |
|
[MAN]A:906 |
4 |
1 |
290 |
cf |
[BMA]A:905 |
x,y,z |
1_555 |
4 |
1 |
291 |
50.2 |
2.4 |
0.341 |
0 |
0 |
0 |
0.000 |
46 |
|
[CA]A:914 |
1 |
1 |
85 |
f |
A |
x,y,z |
1_555 |
6 |
6 |
31978 |
43.5 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.009 |
47 |
|
A |
8 |
3 |
31978 |
f |
[EDO]A:933 |
x-1,y,z |
1_455 |
3 |
1 |
185 |
42.0 |
0.8 |
0.694 |
0 |
0 |
0 |
0.000 |
48 |
|
[EDO]A:936 |
4 |
1 |
183 |
f |
[MAN]A:907 |
x,y,z |
1_555 |
6 |
1 |
289 |
41.5 |
1.1 |
0.352 |
2 |
0 |
0 |
0.000 |
49 |
|
[MAN]A:907 |
5 |
1 |
289 |
f |
[NAG]A:904 |
x,y,z |
1_555 |
5 |
1 |
362 |
38.8 |
2.1 |
0.282 |
0 |
0 |
0 |
0.000 |
50 |
|
A |
2 |
1 |
31978 |
◊ |
[EDO]A:926 |
-x+1,y-1/2,-z |
2_645 |
3 |
1 |
184 |
38.7 |
1.6 |
0.990 |
2 |
0 |
0 |
0.000 |
51 |
|
[ZN]A:913 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
4 |
31978 |
36.2 |
-26.2 |
0.000 |
0 |
0 |
0 |
0.018 |
52 |
|
[NAG]A:911 |
4 |
1 |
360 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
31978 |
36.0 |
0.3 |
0.326 |
1 |
0 |
0 |
0.000 |
53 |
|
[MAN]A:908 |
4 |
1 |
290 |
f |
[MAN]A:906 |
x,y,z |
1_555 |
4 |
1 |
290 |
31.1 |
1.3 |
0.250 |
0 |
0 |
0 |
0.000 |
54 |
|
A |
3 |
1 |
31978 |
◊ |
[MAN]A:909 |
-x,y-1/2,-z |
2_545 |
2 |
1 |
289 |
27.6 |
-0.9 |
0.074 |
0 |
0 |
0 |
0.000 |
55 |
|
[MAN]A:908 |
2 |
1 |
290 |
f |
[BMA]A:905 |
x,y,z |
1_555 |
5 |
1 |
291 |
27.3 |
1.2 |
0.224 |
0 |
0 |
0 |
0.000 |
56 |
|
A |
1 |
1 |
31978 |
x |
A |
-x+1,y-1/2,-z-1 |
2_644 |
2 |
1 |
31978 |
27.0 |
0.3 |
0.787 |
1 |
0 |
0 |
0.000 |
57 |
|
[EDO]A:936 |
4 |
1 |
183 |
f |
[MAN]A:908 |
x,y,z |
1_555 |
6 |
1 |
290 |
26.7 |
1.2 |
0.407 |
0 |
0 |
0 |
0.000 |
58 |
|
[SO4]A:917 |
3 |
1 |
185 |
f |
[ZN]A:913 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.5 |
-13.8 |
0.000 |
0 |
0 |
0 |
0.010 |
59 |
|
A |
3 |
1 |
31978 |
◊ |
[NAG]A:911 |
x-1,y,z |
1_455 |
2 |
1 |
360 |
22.6 |
1.2 |
0.720 |
0 |
0 |
0 |
0.000 |
60 |
|
[EDO]A:926 |
4 |
1 |
184 |
f |
[SCN]A:918 |
x,y,z |
1_555 |
3 |
1 |
184 |
22.2 |
-0.1 |
0.861 |
0 |
0 |
0 |
0.000 |
61 |
|
[SO4]A:917 |
3 |
1 |
185 |
f |
[ZN]A:912 |
x,y,z |
1_555 |
1 |
1 |
98 |
19.3 |
-10.7 |
0.000 |
0 |
0 |
0 |
0.007 |
62 |
|
[MAN]A:907 |
2 |
1 |
289 |
f |
[BMA]A:905 |
x,y,z |
1_555 |
2 |
1 |
291 |
11.1 |
0.5 |
0.256 |
0 |
0 |
0 |
0.000 |
63 |
|
[MAN]A:906 |
3 |
1 |
290 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
31978 |
10.7 |
-0.2 |
0.229 |
0 |
0 |
0 |
0.000 |
64 |
|
[EDO]A:935 |
1 |
1 |
183 |
f |
[EDO]A:927 |
x,y,z |
1_555 |
2 |
1 |
185 |
9.3 |
0.3 |
1.000 |
0 |
0 |
0 |
0.000 |
65 |
|
[MAN]A:909 |
1 |
1 |
289 |
f |
[NAG]A:904 |
x,y,z |
1_555 |
2 |
1 |
362 |
8.6 |
0.2 |
0.193 |
0 |
0 |
0 |
0.000 |
66 |
|
[ZN]A:913 |
1 |
1 |
98 |
f |
[ZN]A:912 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.5 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.004 |
67 |
|
[MAN]A:908 |
2 |
1 |
290 |
f |
[NAG]A:903 |
x,y,z |
1_555 |
1 |
1 |
361 |
4.3 |
-0.2 |
0.175 |
0 |
0 |
0 |
0.000 |
68 |
|
A |
1 |
1 |
31978 |
◊ |
[SCN]A:918 |
-x+1,y-1/2,-z |
2_645 |
2 |
1 |
184 |
4.0 |
0.1 |
0.762 |
0 |
0 |
0 |
0.000 |
69 |
|
[DWW]A:937 |
1 |
1 |
566 |
f |
[SO4]A:917 |
x,y,z |
1_555 |
1 |
1 |
185 |
3.2 |
-0.4 |
0.956 |
0 |
0 |
0 |
0.000 |
70 |
|
[EDO]A:931 |
1 |
1 |
183 |
f |
A |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
31978 |
3.2 |
0.0 |
0.585 |
0 |
0 |
0 |
0.000 |
71 |
|
A |
1 |
1 |
31978 |
◊ |
[NAG]A:911 |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
360 |
0.6 |
0.0 |
0.312 |
0 |
0 |
0 |
0.000 |
|