## |
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 |
149 |
39 |
10861 |
◊ |
B |
x,y,z |
1_555 |
168 |
47 |
10194 |
1541.0 |
-20.9 |
0.081 |
9 |
4 |
0 |
0.146 |
2 |
|
E |
150 |
38 |
10427 |
◊ |
D |
x,y,z |
1_555 |
154 |
41 |
10135 |
1503.2 |
-21.5 |
0.033 |
7 |
0 |
0 |
0.152 |
3 |
|
B |
92 |
27 |
10194 |
◊ |
D |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
106 |
29 |
10135 |
949.7 |
-4.4 |
0.571 |
5 |
3 |
0 |
0.041 |
4 |
|
A |
92 |
24 |
10861 |
◊ |
A |
y,x,-z |
7_555 |
89 |
24 |
10861 |
867.6 |
-11.9 |
0.156 |
2 |
0 |
0 |
0.076 |
5 |
|
A |
68 |
16 |
10861 |
◊ |
E |
y,x,-z |
7_555 |
61 |
16 |
10427 |
590.4 |
-0.5 |
0.719 |
4 |
1 |
0 |
0.013 |
6 |
|
[RHQ]A:201 |
32 |
1 |
748 |
◊ |
A |
x,y,z |
1_555 |
69 |
21 |
10861 |
501.7 |
2.3 |
0.486 |
1 |
0 |
0 |
0.000 |
7 |
|
A |
43 |
11 |
10861 |
◊ |
E |
x,y,z |
1_555 |
51 |
15 |
10427 |
397.9 |
-3.1 |
0.463 |
3 |
1 |
0 |
0.025 |
8 |
|
D |
38 |
10 |
10135 |
◊ |
D |
y,x,-z+1 |
7_556 |
35 |
10 |
10135 |
338.1 |
-2.7 |
0.433 |
0 |
0 |
0 |
0.008 |
9 |
|
B |
33 |
11 |
10194 |
◊ |
B |
-y-1,-x-1,-z |
8_445 |
33 |
11 |
10194 |
279.4 |
-3.0 |
0.427 |
0 |
0 |
0 |
0.017 |
10 |
|
B |
19 |
4 |
10194 |
◊ |
B |
y,x,-z |
7_555 |
19 |
4 |
10194 |
188.9 |
-0.6 |
0.627 |
2 |
0 |
0 |
0.009 |
11 |
|
D |
28 |
9 |
10135 |
◊ |
B |
-y-1/2,x+1/2,z+1/2 |
3_455 |
24 |
8 |
10194 |
180.2 |
-2.3 |
0.420 |
0 |
0 |
0 |
0.013 |
12 |
|
E |
18 |
5 |
10427 |
◊ |
E |
y,x,-z+1 |
7_556 |
18 |
5 |
10427 |
159.6 |
-2.4 |
0.305 |
0 |
0 |
0 |
0.014 |
13 |
|
[SO4]B:600 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
10194 |
113.6 |
-19.0 |
0.708 |
1 |
0 |
0 |
0.240 |
14 |
|
[SO4]E:399 |
5 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
18 |
8 |
10427 |
112.6 |
-17.9 |
0.584 |
1 |
0 |
0 |
0.216 |
15 |
|
[SO4]D:901 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
20 |
8 |
10135 |
112.1 |
-18.1 |
0.607 |
1 |
0 |
0 |
0.115 |
16 |
|
[SO4]A:802 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
10861 |
89.7 |
-14.6 |
0.540 |
5 |
0 |
0 |
0.201 |
17 |
|
A |
12 |
4 |
10861 |
◊ |
B |
y,x,-z |
7_555 |
9 |
2 |
10194 |
89.4 |
-0.5 |
0.555 |
2 |
0 |
0 |
0.007 |
18 |
|
[SO4]E:901 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
12 |
5 |
10427 |
86.4 |
-12.7 |
0.717 |
4 |
0 |
0 |
0.170 |
19 |
|
[SO4]D:899 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
10135 |
86.1 |
-13.3 |
0.708 |
3 |
0 |
0 |
0.091 |
20 |
|
[SO4]D:900 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
13 |
5 |
10135 |
84.3 |
-13.3 |
0.537 |
3 |
0 |
0 |
0.091 |
21 |
|
[SO4]E:900 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
11 |
5 |
10427 |
82.9 |
-11.6 |
0.783 |
4 |
0 |
0 |
0.158 |
22 |
|
[SO4]E:902 |
5 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
11 |
3 |
10427 |
79.6 |
-10.3 |
0.903 |
3 |
0 |
0 |
0.137 |
23 |
|
[SO4]B:199 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
10194 |
79.5 |
-10.5 |
0.908 |
3 |
0 |
0 |
0.146 |
24 |
|
[SO4]B:1000 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
10194 |
79.2 |
-10.9 |
0.837 |
3 |
0 |
0 |
0.152 |
25 |
|
[SO4]A:699 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
10861 |
78.1 |
-11.9 |
0.619 |
3 |
0 |
0 |
0.158 |
26 |
|
[SO4]A:599 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
10861 |
77.3 |
-11.5 |
0.753 |
2 |
0 |
0 |
0.147 |
27 |
|
[SO4]A:800 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
10861 |
77.1 |
-12.0 |
0.616 |
2 |
0 |
0 |
0.154 |
28 |
|
[SO4]D:999 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
13 |
4 |
10135 |
76.7 |
-12.0 |
0.667 |
0 |
0 |
0 |
0.074 |
29 |
|
[SO4]A:299 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
10861 |
75.9 |
-9.6 |
0.890 |
2 |
0 |
0 |
0.125 |
30 |
|
[SO4]B:499 |
5 |
1 |
186 |
◊ |
D |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
9 |
4 |
10135 |
74.5 |
-11.1 |
0.868 |
2 |
0 |
0 |
0.070 |
31 |
|
[SO4]A:801 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
10861 |
73.0 |
-9.6 |
0.786 |
1 |
0 |
0 |
0.120 |
32 |
|
[SO4]B:700 |
5 |
1 |
187 |
f |
B |
-x-1,-y-1,z |
2_445 |
8 |
3 |
10194 |
71.7 |
-8.4 |
0.939 |
4 |
0 |
0 |
0.125 |
33 |
|
[SO4]A:799 |
4 |
1 |
184 |
f |
E |
x,y,z |
1_555 |
11 |
4 |
10427 |
71.7 |
-10.9 |
0.707 |
1 |
0 |
0 |
0.133 |
34 |
|
[SO4]A:799 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
12 |
3 |
10861 |
68.6 |
-10.5 |
0.601 |
0 |
0 |
0 |
0.058 |
35 |
|
[SO4]B:199 |
5 |
1 |
187 |
◊ |
D |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
9 |
5 |
10135 |
66.6 |
-7.9 |
0.923 |
2 |
0 |
0 |
0.051 |
36 |
|
[SO4]E:903 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
6 |
2 |
10427 |
61.8 |
-7.9 |
0.845 |
0 |
0 |
0 |
0.093 |
37 |
|
B |
9 |
3 |
10194 |
f |
[SO4]D:1000 |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
4 |
1 |
186 |
59.8 |
-8.1 |
0.622 |
0 |
0 |
0 |
0.100 |
38 |
|
[SO4]D:1000 |
4 |
1 |
186 |
◊ |
D |
x,y,z |
1_555 |
7 |
3 |
10135 |
58.9 |
-7.2 |
0.856 |
0 |
0 |
0 |
0.042 |
39 |
|
[SO4]B:601 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
10194 |
54.5 |
-5.8 |
0.949 |
1 |
0 |
0 |
0.077 |
40 |
|
[SO4]B:700 |
5 |
1 |
187 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
10194 |
45.3 |
-5.6 |
0.823 |
0 |
0 |
0 |
0.069 |
41 |
|
[SO4]D:900 |
4 |
1 |
187 |
◊ |
B |
-y-1/2,x+1/2,z+1/2 |
3_455 |
4 |
1 |
10194 |
44.9 |
-4.7 |
0.909 |
1 |
0 |
0 |
0.028 |
42 |
|
[SO4]B:700 |
3 |
1 |
187 |
◊ |
B |
-y-1,-x-1,-z |
8_445 |
5 |
3 |
10194 |
39.0 |
-4.5 |
0.860 |
2 |
0 |
0 |
0.061 |
43 |
|
[SO4]D:1000 |
4 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
6 |
1 |
10427 |
36.5 |
-4.6 |
0.603 |
0 |
0 |
0 |
0.017 |
44 |
|
[SO4]B:499 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
2 |
1 |
10194 |
33.4 |
-2.9 |
0.982 |
1 |
0 |
0 |
0.041 |
45 |
|
B |
2 |
1 |
10194 |
◊ |
B |
-x-1,-y-1,z |
2_445 |
2 |
1 |
10194 |
30.4 |
-0.1 |
0.571 |
1 |
0 |
0 |
0.003 |
46 |
|
[SO4]A:699 |
3 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
10427 |
29.9 |
-3.4 |
0.897 |
0 |
0 |
0 |
0.019 |
47 |
|
D |
3 |
1 |
10135 |
◊ |
[SO4]B:601 |
-y-1/2,x+1/2,z+1/2 |
3_455 |
4 |
1 |
185 |
28.2 |
-3.2 |
0.812 |
1 |
0 |
0 |
0.019 |
48 |
|
[SO4]A:299 |
4 |
1 |
187 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
10427 |
27.1 |
-2.2 |
0.957 |
0 |
0 |
0 |
0.012 |
49 |
|
[SO4]E:901 |
2 |
1 |
185 |
◊ |
E |
y,x,-z+1 |
7_556 |
1 |
1 |
10427 |
27.0 |
-2.2 |
0.970 |
1 |
0 |
0 |
0.032 |
50 |
|
[SO4]A:802 |
3 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
6 |
2 |
10427 |
26.3 |
-2.8 |
0.834 |
0 |
0 |
0 |
0.015 |
51 |
|
[RHQ]A:201 |
2 |
1 |
748 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
10194 |
20.7 |
0.3 |
0.523 |
0 |
0 |
0 |
0.000 |
52 |
|
B |
3 |
1 |
10194 |
◊ |
E |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
3 |
1 |
10427 |
20.1 |
-0.2 |
0.481 |
0 |
0 |
0 |
0.000 |
53 |
|
[SO4]E:901 |
1 |
1 |
185 |
◊ |
[SO4]E:900 |
y,x,-z+1 |
7_556 |
4 |
1 |
185 |
15.3 |
-3.4 |
0.894 |
0 |
0 |
0 |
0.040 |
54 |
|
[SO4]E:399 |
2 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
10861 |
14.8 |
-1.9 |
0.718 |
0 |
0 |
0 |
0.011 |
55 |
|
[SO4]B:700 |
3 |
1 |
187 |
◊ |
[SO4]B:700 |
-x-1,-y-1,z |
2_445 |
3 |
1 |
187 |
13.5 |
-3.1 |
0.992 |
0 |
0 |
0 |
0.019 |
56 |
|
[SO4]B:499 |
4 |
1 |
186 |
◊ |
[SO4]D:901 |
x-1/2,-y-1/2,-z+1/2 |
6_445 |
1 |
1 |
186 |
11.8 |
-2.5 |
0.894 |
0 |
0 |
0 |
0.015 |
57 |
|
[SO4]B:499 |
1 |
1 |
186 |
f |
[SO4]B:199 |
x,y,z |
1_555 |
3 |
1 |
187 |
11.7 |
-2.5 |
0.891 |
0 |
0 |
0 |
0.031 |
58 |
|
[SO4]A:802 |
3 |
1 |
186 |
f |
[SO4]A:299 |
x,y,z |
1_555 |
1 |
1 |
187 |
7.0 |
-1.6 |
0.891 |
0 |
0 |
0 |
0.020 |
59 |
|
A |
2 |
1 |
10861 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
10135 |
6.4 |
0.1 |
0.729 |
0 |
0 |
0 |
0.000 |
60 |
|
[SO4]E:900 |
1 |
1 |
185 |
◊ |
E |
y,x,-z+1 |
7_556 |
1 |
1 |
10427 |
5.0 |
-0.7 |
0.541 |
0 |
0 |
0 |
0.008 |
61 |
|
[SO4]E:399 |
1 |
1 |
186 |
◊ |
[SO4]A:699 |
x,y,z |
1_555 |
1 |
1 |
186 |
2.6 |
-0.6 |
1.000 |
0 |
0 |
0 |
0.003 |
|