| ## |
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 |
177 |
48 |
16034 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
167 |
41 |
15723 |
1497.9 |
-1.0 |
0.553 |
10 |
5 |
0 |
0.012 |
2 |
|
B |
143 |
35 |
15723 |
◊ |
A |
-y+2,x-y+1,z-1/3 |
2_764 |
133 |
35 |
16034 |
1159.6 |
-3.5 |
0.441 |
17 |
10 |
0 |
0.026 |
3 |
|
A |
34 |
8 |
16034 |
◊ |
B |
-y+1,x-y,z+2/3 |
2_655 |
41 |
14 |
15723 |
350.6 |
-1.1 |
0.397 |
0 |
2 |
0 |
0.000 |
4 |
|
B |
43 |
14 |
15723 |
◊ |
A |
-x+1,-x+y,-z+2/3 |
6_655 |
33 |
11 |
16034 |
303.7 |
-0.4 |
0.391 |
2 |
2 |
0 |
0.000 |
5 |
|
B |
23 |
9 |
15723 |
◊ |
B |
y,x,-z |
4_555 |
23 |
9 |
15723 |
221.1 |
2.0 |
0.777 |
2 |
4 |
0 |
0.000 |
6 |
|
A |
31 |
11 |
16034 |
x |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
14 |
7 |
16034 |
181.5 |
0.5 |
0.631 |
1 |
0 |
0 |
0.000 |
7 |
|
[SO4]B:827 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
24 |
8 |
15723 |
114.8 |
-17.0 |
0.638 |
1 |
0 |
0 |
0.036 |
8 |
|
[SO4]A:809 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
25 |
10 |
16034 |
112.9 |
-13.2 |
0.640 |
2 |
0 |
0 |
0.029 |
9 |
|
[SO4]A:801 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
22 |
8 |
16034 |
109.7 |
-17.3 |
0.577 |
2 |
0 |
0 |
0.038 |
10 |
|
[SO4]B:822 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
26 |
9 |
15723 |
108.1 |
-15.6 |
0.609 |
0 |
0 |
0 |
0.033 |
11 |
|
A |
12 |
5 |
16034 |
◊ |
B |
x-y,-y+2,-z+1/3 |
5_575 |
15 |
5 |
15723 |
107.2 |
0.3 |
0.625 |
0 |
0 |
0 |
0.000 |
12 |
|
[SO4]A:811 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
19 |
6 |
16034 |
105.2 |
-15.0 |
0.795 |
2 |
0 |
0 |
0.033 |
13 |
|
[SO4]A:804 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
16034 |
103.8 |
-17.0 |
0.607 |
5 |
0 |
0 |
0.040 |
14 |
|
[SO4]A:814 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
16034 |
102.6 |
-12.9 |
0.915 |
3 |
0 |
0 |
0.030 |
15 |
|
[SO4]B:828 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
15723 |
101.1 |
-13.5 |
0.801 |
2 |
0 |
0 |
0.030 |
16 |
|
[SO4]B:819 |
5 |
1 |
188 |
f |
A |
-y+2,x-y+1,z-1/3 |
2_764 |
20 |
8 |
16034 |
99.4 |
-15.5 |
0.644 |
1 |
0 |
0 |
0.033 |
17 |
|
[SO4]B:817 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
20 |
7 |
15723 |
98.1 |
-16.4 |
0.622 |
4 |
0 |
0 |
0.038 |
18 |
|
[SO4]B:815 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
7 |
15723 |
97.7 |
-16.3 |
0.700 |
4 |
0 |
0 |
0.038 |
19 |
|
[SO4]A:806 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
16034 |
97.2 |
-16.4 |
0.624 |
5 |
0 |
0 |
0.039 |
20 |
|
[SO4]B:824 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
15723 |
95.3 |
-14.8 |
0.567 |
1 |
0 |
0 |
0.032 |
21 |
|
[SO4]A:813 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
16034 |
94.1 |
-14.8 |
0.563 |
1 |
0 |
0 |
0.032 |
22 |
|
[SO4]B:829 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
15723 |
93.6 |
-12.7 |
0.648 |
2 |
0 |
0 |
0.028 |
23 |
|
[SO4]A:802 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
16034 |
92.4 |
-11.0 |
0.938 |
3 |
0 |
0 |
0.026 |
24 |
|
[SO4]B:818 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
12 |
3 |
15723 |
88.0 |
-10.6 |
0.877 |
0 |
0 |
0 |
0.022 |
25 |
|
[SO4]A:808 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
16034 |
83.2 |
-14.5 |
0.713 |
5 |
0 |
0 |
0.035 |
26 |
|
[SO4]B:830 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
15723 |
82.3 |
-11.6 |
0.699 |
4 |
0 |
0 |
0.028 |
27 |
|
[SO4]A:805 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
16034 |
81.2 |
-11.4 |
0.758 |
3 |
0 |
0 |
0.026 |
28 |
|
[SO4]A:803 |
5 |
1 |
186 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
12 |
4 |
15723 |
79.7 |
-10.0 |
0.925 |
1 |
0 |
0 |
0.020 |
29 |
|
[SO4]B:826 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
11 |
3 |
15723 |
75.0 |
-12.1 |
0.730 |
2 |
0 |
0 |
0.027 |
30 |
|
[SO4]B:832 |
4 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
15723 |
71.5 |
-7.9 |
0.935 |
3 |
0 |
0 |
0.019 |
31 |
|
[SO4]B:833 |
5 |
1 |
191 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
15723 |
71.5 |
-8.4 |
0.912 |
0 |
0 |
0 |
0.017 |
32 |
|
[SO4]B:823 |
4 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
14 |
4 |
15723 |
62.4 |
-8.6 |
0.688 |
1 |
0 |
0 |
0.019 |
33 |
|
[SO4]B:821 |
4 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
15723 |
61.7 |
-8.0 |
0.750 |
0 |
0 |
0 |
0.017 |
34 |
|
[SO4]B:826 |
5 |
1 |
188 |
◊ |
A |
-y+2,x-y+1,z-1/3 |
2_764 |
10 |
4 |
16034 |
61.6 |
-9.8 |
0.517 |
1 |
0 |
0 |
0.021 |
35 |
|
[SO4]A:807 |
4 |
1 |
187 |
f |
B |
x-y,-y+1,-z+1/3 |
5_565 |
11 |
3 |
15723 |
60.8 |
-7.4 |
0.866 |
0 |
0 |
0 |
0.015 |
36 |
|
[SO4]A:802 |
5 |
1 |
186 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
8 |
2 |
15723 |
57.7 |
-7.5 |
0.783 |
3 |
0 |
0 |
0.017 |
37 |
|
B |
7 |
3 |
15723 |
◊ |
[SO4]A:814 |
-x+1,-x+y,-z+2/3 |
6_655 |
5 |
1 |
187 |
57.6 |
-7.2 |
0.563 |
0 |
0 |
0 |
0.000 |
38 |
|
A |
13 |
4 |
16034 |
◊ |
[SO4]B:833 |
x-y,-y+1,-z+1/3 |
5_565 |
5 |
1 |
191 |
56.3 |
-7.7 |
0.596 |
0 |
0 |
0 |
0.015 |
39 |
|
[SO4]A:812 |
4 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
9 |
2 |
16034 |
55.0 |
-7.1 |
0.779 |
0 |
0 |
0 |
0.015 |
40 |
|
[SO4]A:810 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
16034 |
54.3 |
-7.2 |
0.705 |
2 |
0 |
0 |
0.017 |
41 |
|
[SO4]A:803 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
2 |
16034 |
52.8 |
-7.1 |
0.717 |
1 |
0 |
0 |
0.016 |
42 |
|
[SO4]B:819 |
4 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
15723 |
52.5 |
-5.1 |
0.930 |
1 |
0 |
0 |
0.012 |
43 |
|
[SO4]B:825 |
3 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
15723 |
51.4 |
-6.6 |
0.742 |
1 |
0 |
0 |
0.015 |
44 |
|
A |
6 |
3 |
16034 |
◊ |
[SO4]B:828 |
x-y,-y+1,-z+1/3 |
5_565 |
4 |
1 |
187 |
50.3 |
-6.6 |
0.546 |
0 |
0 |
0 |
0.013 |
45 |
|
[SO4]B:820 |
4 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
6 |
2 |
15723 |
49.7 |
-5.5 |
0.900 |
1 |
0 |
0 |
0.012 |
46 |
|
[SO4]B:831 |
4 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
15723 |
46.9 |
-5.2 |
0.863 |
0 |
0 |
0 |
0.011 |
47 |
|
B |
9 |
4 |
15723 |
◊ |
[SO4]A:808 |
-y+2,x-y+1,z-1/3 |
2_764 |
4 |
1 |
187 |
46.7 |
-6.6 |
0.676 |
1 |
0 |
0 |
0.015 |
48 |
|
[SO4]A:809 |
4 |
1 |
188 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
6 |
2 |
15723 |
44.2 |
-5.5 |
0.499 |
0 |
0 |
0 |
0.011 |
49 |
|
[SO4]A:805 |
4 |
1 |
187 |
◊ |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
7 |
1 |
16034 |
42.5 |
-5.2 |
0.664 |
1 |
0 |
0 |
0.000 |
50 |
|
[SO4]A:810 |
3 |
1 |
186 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
3 |
2 |
15723 |
40.2 |
-3.7 |
0.942 |
1 |
0 |
0 |
0.008 |
51 |
|
[SO4]A:805 |
3 |
1 |
187 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
4 |
2 |
15723 |
37.2 |
-4.7 |
0.727 |
1 |
0 |
0 |
0.010 |
52 |
|
[SO4]B:832 |
4 |
1 |
187 |
f |
[SO4]B:818 |
x,y,z |
1_555 |
4 |
1 |
189 |
34.8 |
-7.7 |
0.998 |
0 |
0 |
0 |
0.016 |
53 |
|
[SO4]B:832 |
3 |
1 |
187 |
f |
[SO4]B:822 |
x,y,z |
1_555 |
4 |
1 |
188 |
32.4 |
-7.2 |
0.995 |
0 |
0 |
0 |
0.015 |
54 |
|
[SO4]B:831 |
4 |
1 |
188 |
◊ |
A |
-y+2,x-y+1,z-1/3 |
2_764 |
3 |
1 |
16034 |
31.6 |
-3.0 |
0.901 |
0 |
0 |
0 |
0.006 |
55 |
|
[SO4]B:825 |
3 |
1 |
188 |
f |
[SO4]B:821 |
x,y,z |
1_555 |
3 |
1 |
188 |
31.1 |
-7.0 |
0.992 |
0 |
0 |
0 |
0.015 |
56 |
|
A |
4 |
2 |
16034 |
◊ |
[SO4]B:824 |
x-y,-y+1,-z+1/3 |
5_565 |
2 |
1 |
187 |
31.1 |
-3.7 |
0.854 |
1 |
0 |
0 |
0.008 |
57 |
|
[SO4]A:804 |
3 |
1 |
184 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
5 |
2 |
15723 |
31.1 |
-4.3 |
0.638 |
0 |
0 |
0 |
0.008 |
58 |
|
A |
5 |
1 |
16034 |
◊ |
[SO4]B:827 |
x-y,-y+1,-z+1/3 |
5_565 |
4 |
1 |
187 |
30.6 |
-4.1 |
0.519 |
0 |
0 |
0 |
0.008 |
59 |
|
[SO4]A:812 |
3 |
1 |
188 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
7 |
2 |
15723 |
28.9 |
-3.6 |
0.722 |
0 |
0 |
0 |
0.007 |
60 |
|
[SO4]A:809 |
4 |
1 |
188 |
f |
[SO4]A:801 |
x,y,z |
1_555 |
4 |
1 |
187 |
26.4 |
-6.0 |
0.998 |
0 |
0 |
0 |
0.013 |
61 |
|
[SO4]B:822 |
4 |
1 |
188 |
f |
[SO4]B:818 |
x,y,z |
1_555 |
3 |
1 |
189 |
24.1 |
-5.4 |
0.995 |
0 |
0 |
0 |
0.011 |
62 |
|
[SO4]B:821 |
3 |
1 |
188 |
◊ |
B |
y,x-1,-z |
4_545 |
1 |
1 |
15723 |
22.1 |
-2.3 |
0.959 |
1 |
0 |
0 |
0.000 |
63 |
|
[SO4]A:801 |
1 |
1 |
187 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
2 |
1 |
15723 |
14.3 |
-1.9 |
0.452 |
0 |
0 |
0 |
0.004 |
64 |
|
A |
2 |
1 |
16034 |
x |
A |
-x+1,-x+y,-z+2/3 |
6_655 |
1 |
1 |
16034 |
11.0 |
0.5 |
0.859 |
0 |
0 |
0 |
0.000 |
65 |
|
[SO4]B:829 |
1 |
1 |
187 |
f |
[SO4]B:825 |
x,y,z |
1_555 |
3 |
1 |
188 |
10.6 |
-2.4 |
0.891 |
0 |
0 |
0 |
0.005 |
66 |
|
A |
1 |
1 |
16034 |
◊ |
[SO4]B:829 |
x-y,-y+1,-z+1/3 |
5_565 |
2 |
1 |
187 |
8.6 |
-0.7 |
0.939 |
0 |
0 |
0 |
0.001 |
67 |
|
[SO4]A:803 |
1 |
1 |
186 |
◊ |
[SO4]B:824 |
x-y,-y+1,-z+1/3 |
5_565 |
3 |
1 |
187 |
7.6 |
-1.6 |
0.891 |
0 |
0 |
0 |
0.003 |
68 |
|
B |
2 |
1 |
15723 |
x |
B |
y,x-1,-z |
4_545 |
2 |
1 |
15723 |
7.3 |
-0.0 |
0.546 |
0 |
0 |
0 |
0.000 |
69 |
|
B |
2 |
1 |
15723 |
◊ |
[SO4]A:813 |
-y+2,x-y+1,z-1/3 |
2_764 |
1 |
1 |
186 |
6.8 |
-0.2 |
0.866 |
0 |
0 |
0 |
0.000 |
70 |
|
[SO4]A:802 |
2 |
1 |
186 |
◊ |
[SO4]B:829 |
x-y,-y+1,-z+1/3 |
5_565 |
1 |
1 |
187 |
6.2 |
-1.5 |
0.876 |
0 |
0 |
0 |
0.003 |
71 |
|
[SO4]B:819 |
1 |
1 |
188 |
◊ |
B |
y,x-1,-z |
4_545 |
1 |
1 |
15723 |
0.7 |
-0.1 |
0.865 |
0 |
0 |
0 |
0.000 |
|