| ## |
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 |
|
L |
195 |
53 |
11226 |
◊ |
H |
x,y,z |
1_555 |
181 |
50 |
11676 |
1702.0 |
-27.7 |
0.018 |
9 |
0 |
0 |
0.556 |
2 |
|
B |
177 |
52 |
11121 |
◊ |
A |
x,y,z |
1_555 |
169 |
50 |
10904 |
1571.0 |
-24.3 |
0.026 |
11 |
2 |
0 |
0.319 |
3 |
|
A |
73 |
22 |
10904 |
◊ |
E |
x,y,z |
1_555 |
67 |
22 |
10099 |
650.5 |
-0.2 |
0.801 |
16 |
1 |
0 |
0.131 |
4 |
|
E |
69 |
22 |
10099 |
◊ |
H |
x,y,z |
1_555 |
64 |
17 |
11676 |
569.6 |
-3.9 |
0.489 |
8 |
0 |
0 |
0.091 |
5 |
|
E |
63 |
16 |
10099 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
54 |
18 |
11121 |
558.5 |
-0.6 |
0.573 |
8 |
0 |
0 |
0.037 |
6 |
|
A |
47 |
15 |
10904 |
◊ |
B |
x-1,y,z |
1_455 |
47 |
16 |
11121 |
425.9 |
2.2 |
0.837 |
11 |
1 |
0 |
0.000 |
7 |
|
A |
46 |
15 |
10904 |
◊ |
E |
x-1,y,z |
1_455 |
40 |
10 |
10099 |
415.6 |
0.1 |
0.689 |
1 |
0 |
0 |
0.002 |
8 |
|
E |
52 |
15 |
10099 |
◊ |
L |
x,y,z |
1_555 |
40 |
12 |
11226 |
379.4 |
-3.2 |
0.400 |
9 |
0 |
0 |
0.073 |
9 |
|
L |
45 |
15 |
11226 |
◊ |
E |
x-1/2,-y-1/2,-z |
4_445 |
39 |
13 |
10099 |
364.5 |
-2.7 |
0.420 |
7 |
0 |
0 |
0.071 |
10 |
|
B |
41 |
12 |
11121 |
◊ |
E |
x,y,z |
1_555 |
42 |
11 |
10099 |
343.0 |
-1.3 |
0.323 |
2 |
0 |
0 |
0.017 |
11 |
|
L |
36 |
15 |
11226 |
◊ |
H |
x-1/2,-y-1/2,-z |
4_445 |
43 |
11 |
11676 |
333.8 |
-2.1 |
0.524 |
4 |
0 |
0 |
0.093 |
12 |
|
A |
25 |
11 |
10904 |
◊ |
L |
-x,y-1/2,-z-1/2 |
3_544 |
25 |
9 |
11226 |
230.7 |
-2.8 |
0.332 |
1 |
0 |
0 |
0.000 |
13 |
|
[NAG]E:702 |
11 |
1 |
359 |
cf |
E |
x,y,z |
1_555 |
16 |
7 |
10099 |
155.3 |
4.2 |
0.474 |
0 |
0 |
0 |
0.000 |
14 |
|
[PEG]A:401 |
7 |
1 |
254 |
◊ |
A |
x,y,z |
1_555 |
22 |
8 |
10904 |
134.7 |
2.3 |
0.338 |
1 |
0 |
0 |
0.000 |
15 |
|
[GOL]E:701 |
6 |
1 |
220 |
f |
E |
x,y,z |
1_555 |
25 |
9 |
10099 |
121.2 |
-0.8 |
0.463 |
0 |
0 |
0 |
0.013 |
16 |
|
[SO4]B:302 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
17 |
9 |
11121 |
103.3 |
-14.0 |
0.872 |
4 |
0 |
0 |
0.170 |
17 |
|
B |
9 |
3 |
11121 |
x |
B |
x-1,y,z |
1_455 |
16 |
7 |
11121 |
103.3 |
-0.8 |
0.464 |
2 |
0 |
0 |
0.000 |
18 |
|
[GOL]E:704 |
6 |
1 |
217 |
f |
E |
x,y,z |
1_555 |
12 |
6 |
10099 |
103.1 |
1.2 |
0.729 |
5 |
0 |
0 |
0.017 |
19 |
|
[SO4]H:302 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
15 |
8 |
11676 |
99.7 |
-13.9 |
0.850 |
4 |
0 |
0 |
0.373 |
20 |
|
[SO4]E:706 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
8 |
5 |
10099 |
85.3 |
-9.5 |
0.956 |
3 |
0 |
0 |
0.189 |
21 |
|
[GOL]E:703 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
11121 |
81.6 |
-1.1 |
0.359 |
0 |
0 |
0 |
0.012 |
22 |
|
[PEG]A:401 |
6 |
1 |
254 |
f |
E |
x-1,y,z |
1_455 |
8 |
4 |
10099 |
78.2 |
1.6 |
0.246 |
1 |
0 |
0 |
0.000 |
23 |
|
[SO4]H:301 |
5 |
1 |
185 |
f |
H |
x,y,z |
1_555 |
15 |
5 |
11676 |
69.5 |
-9.3 |
0.792 |
0 |
0 |
0 |
0.221 |
24 |
|
[CL]A:404 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
10904 |
68.8 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.201 |
25 |
|
[SO4]E:707 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
7 |
5 |
10099 |
66.3 |
-7.5 |
0.947 |
2 |
0 |
0 |
0.146 |
26 |
|
[SO4]E:705 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
10904 |
65.4 |
-8.9 |
0.833 |
4 |
0 |
0 |
0.187 |
27 |
|
[SO4]A:402 |
5 |
1 |
186 |
f |
B |
x-1,y,z |
1_455 |
14 |
4 |
11121 |
65.3 |
-8.5 |
0.834 |
1 |
0 |
0 |
0.096 |
28 |
|
L |
13 |
5 |
11226 |
◊ |
[SO4]H:301 |
x-1/2,-y-1/2,-z |
4_445 |
5 |
1 |
185 |
64.2 |
-8.1 |
0.722 |
1 |
0 |
0 |
0.204 |
29 |
|
[GOL]E:703 |
5 |
1 |
219 |
◊ |
E |
x,y,z |
1_555 |
11 |
5 |
10099 |
63.0 |
0.4 |
0.681 |
0 |
0 |
0 |
0.000 |
30 |
|
[SO4]A:403 |
5 |
1 |
186 |
f |
E |
x-1,y,z |
1_455 |
7 |
3 |
10099 |
61.5 |
-6.6 |
0.951 |
1 |
0 |
0 |
0.122 |
31 |
|
[SO4]B:301 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
11121 |
58.0 |
-6.3 |
0.917 |
1 |
0 |
0 |
0.073 |
32 |
|
[SO4]B:303 |
5 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
8 |
3 |
11121 |
54.6 |
-7.4 |
0.755 |
2 |
0 |
0 |
0.090 |
33 |
|
B |
5 |
3 |
11121 |
◊ |
H |
-x+1/2,-y,z-1/2 |
2_554 |
10 |
3 |
11676 |
54.6 |
-0.7 |
0.267 |
0 |
0 |
0 |
0.000 |
34 |
|
[SO4]E:707 |
4 |
1 |
185 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
9 |
4 |
11121 |
49.4 |
-6.2 |
0.788 |
0 |
0 |
0 |
0.054 |
35 |
|
[SO4]A:403 |
5 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
10904 |
49.2 |
-5.1 |
0.941 |
2 |
0 |
0 |
0.033 |
36 |
|
B |
7 |
1 |
11121 |
◊ |
[SO4]B:303 |
x-1,y,z |
1_455 |
4 |
1 |
183 |
44.7 |
-4.6 |
0.927 |
1 |
0 |
0 |
0.000 |
37 |
|
[SO4]A:402 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
10904 |
44.4 |
-4.3 |
0.960 |
1 |
0 |
0 |
0.000 |
38 |
|
L |
4 |
2 |
11226 |
◊ |
[SO4]H:302 |
x-1/2,-y-1/2,-z |
4_445 |
4 |
1 |
185 |
41.7 |
-4.1 |
0.965 |
1 |
0 |
0 |
0.109 |
39 |
|
[GOL]E:704 |
5 |
1 |
217 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
11121 |
39.9 |
-0.1 |
0.538 |
1 |
0 |
0 |
0.004 |
40 |
|
[GOL]E:704 |
3 |
1 |
217 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
10904 |
39.8 |
0.3 |
0.718 |
2 |
0 |
0 |
0.010 |
41 |
|
[SO4]E:705 |
3 |
1 |
184 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
10099 |
38.2 |
-4.0 |
0.842 |
1 |
0 |
0 |
0.077 |
42 |
|
[SO4]E:706 |
4 |
1 |
185 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
3 |
2 |
11121 |
34.2 |
-4.3 |
0.660 |
1 |
0 |
0 |
0.042 |
43 |
|
[SO4]H:301 |
4 |
1 |
185 |
◊ |
E |
x,y,z |
1_555 |
4 |
2 |
10099 |
34.2 |
-3.1 |
0.963 |
2 |
0 |
0 |
0.049 |
44 |
|
L |
2 |
2 |
11226 |
◊ |
H |
x-1/2,-y+1/2,-z |
4_455 |
3 |
1 |
11676 |
23.2 |
1.1 |
0.925 |
0 |
0 |
0 |
0.000 |
45 |
|
[SO4]H:302 |
1 |
1 |
185 |
◊ |
L |
x,y,z |
1_555 |
1 |
1 |
11226 |
4.2 |
-0.4 |
0.860 |
0 |
0 |
0 |
0.008 |
46 |
|
B |
1 |
1 |
11121 |
◊ |
L |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
11226 |
0.3 |
0.0 |
0.619 |
0 |
0 |
0 |
0.000 |
|