| ## |
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 |
231 |
65 |
21576 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
229 |
65 |
21576 |
2310.0 |
-28.8 |
0.080 |
24 |
0 |
0 |
0.220 |
2 |
|
B |
132 |
39 |
10403 |
◊ |
A |
x,y,z |
1_555 |
158 |
44 |
21576 |
1392.6 |
-17.3 |
0.289 |
17 |
2 |
0 |
0.202 |
3 |
|
C |
118 |
9 |
4625 |
◊ |
A |
x,y,z |
1_555 |
122 |
41 |
21576 |
1106.5 |
-11.6 |
0.668 |
20 |
0 |
0 |
0.220 |
4 |
|
D |
82 |
16 |
4000 |
◊ |
C |
x,y,z |
1_555 |
80 |
16 |
4625 |
732.9 |
-8.0 |
0.693 |
38 |
0 |
0 |
0.995 |
5 |
|
C |
60 |
8 |
4625 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
67 |
25 |
21576 |
590.1 |
-9.0 |
0.427 |
15 |
0 |
0 |
0.183 |
6 |
|
D |
63 |
12 |
4000 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
68 |
22 |
21576 |
560.9 |
-3.9 |
0.561 |
7 |
0 |
0 |
0.059 |
7 |
|
B |
32 |
12 |
10403 |
◊ |
B |
-y,-x,-z+1/2 |
8_555 |
32 |
12 |
10403 |
287.0 |
-0.4 |
0.849 |
4 |
0 |
0 |
0.000 |
8 |
|
B |
30 |
13 |
10403 |
◊ |
D |
-y+1/2,x+1/2,z+1/4 |
3_555 |
29 |
5 |
4000 |
277.2 |
-3.8 |
0.392 |
3 |
0 |
0 |
0.076 |
9 |
|
D |
27 |
6 |
4000 |
◊ |
A |
x,y,z |
1_555 |
35 |
13 |
21576 |
243.4 |
-2.2 |
0.572 |
2 |
0 |
0 |
0.025 |
10 |
|
B |
31 |
10 |
10403 |
◊ |
C |
-y+1/2,x+1/2,z+1/4 |
3_555 |
25 |
3 |
4625 |
241.7 |
-3.2 |
0.616 |
3 |
0 |
0 |
0.068 |
11 |
|
[CI4]A:1383 |
16 |
1 |
464 |
◊ |
D |
x,y,z |
1_555 |
24 |
2 |
4000 |
155.4 |
0.1 |
0.761 |
0 |
0 |
0 |
0.000 |
12 |
|
[CI4]A:1383 |
19 |
1 |
464 |
f |
A |
x,y,z |
1_555 |
26 |
10 |
21576 |
155.3 |
-4.9 |
0.579 |
5 |
0 |
0 |
0.083 |
13 |
|
A |
20 |
4 |
21576 |
◊ |
B |
x-1/2,-y+1/2,-z-1/4 |
6_454 |
13 |
4 |
10403 |
155.0 |
-2.6 |
0.339 |
2 |
0 |
0 |
0.027 |
14 |
|
[SO4]B:1300 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
22 |
7 |
10403 |
118.7 |
-19.0 |
0.733 |
4 |
0 |
0 |
0.308 |
15 |
|
[GOL]B:1301 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
24 |
6 |
10403 |
111.8 |
-1.5 |
0.468 |
1 |
0 |
0 |
0.028 |
16 |
|
[SO4]A:1384 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
21576 |
103.4 |
-15.7 |
0.697 |
3 |
0 |
0 |
0.198 |
17 |
|
[SO4]A:1376 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
21576 |
100.0 |
-14.9 |
0.877 |
4 |
0 |
0 |
0.194 |
18 |
|
[GOL]A:1379 |
6 |
1 |
212 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
21576 |
100.0 |
-0.5 |
0.592 |
0 |
0 |
0 |
0.006 |
19 |
|
[GOL]A:1378 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
21576 |
86.3 |
-0.6 |
0.538 |
3 |
0 |
0 |
0.022 |
20 |
|
[GOL]A:1380 |
5 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
21576 |
73.5 |
0.5 |
0.689 |
1 |
0 |
0 |
0.000 |
21 |
|
[GOL]B:1301 |
4 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
21576 |
65.4 |
0.0 |
0.533 |
1 |
0 |
0 |
0.003 |
22 |
|
[GOL]A:1380 |
5 |
1 |
221 |
f |
A |
-y,-x,-z-1/2 |
8_554 |
10 |
2 |
21576 |
61.2 |
-0.3 |
0.502 |
1 |
0 |
0 |
0.009 |
23 |
|
[MG]B:1302 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
10403 |
47.3 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.095 |
24 |
|
[NH4]A:1377 |
1 |
1 |
117 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
21576 |
46.5 |
0.7 |
0.817 |
0 |
0 |
0 |
0.000 |
25 |
|
[CI4]A:1383 |
2 |
1 |
464 |
◊ |
C |
x,y,z |
1_555 |
8 |
1 |
4625 |
35.2 |
-3.2 |
0.257 |
0 |
0 |
0 |
0.034 |
26 |
|
[MG]A:1381 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
21576 |
34.2 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.054 |
27 |
|
[CI4]A:1383 |
4 |
1 |
464 |
f |
[MG]A:1381 |
x,y,z |
1_555 |
1 |
1 |
98 |
32.8 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.040 |
28 |
|
[MG]B:1302 |
1 |
1 |
98 |
◊ |
C |
-y+1/2,x+1/2,z+1/4 |
3_555 |
4 |
1 |
4625 |
30.1 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.053 |
29 |
|
[CI4]A:1383 |
5 |
1 |
464 |
f |
[MG]A:1382 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.8 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.034 |
30 |
|
[CI4]A:1383 |
4 |
1 |
464 |
f |
[SO4]A:1384 |
x,y,z |
1_555 |
3 |
1 |
186 |
29.6 |
-3.8 |
0.869 |
0 |
0 |
0 |
0.044 |
31 |
|
[MG]A:1382 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
21576 |
29.0 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.051 |
32 |
|
[NH4]A:1377 |
1 |
1 |
117 |
f |
C |
x,y,z |
1_555 |
4 |
1 |
4625 |
18.3 |
-0.1 |
0.693 |
0 |
0 |
0 |
0.100 |
33 |
|
[MG]A:1382 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
5 |
2 |
4000 |
13.8 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.009 |
34 |
|
B |
1 |
1 |
10403 |
◊ |
C |
-x-1/2,y-1/2,-z+1/4 |
5_445 |
2 |
1 |
4625 |
12.0 |
0.2 |
0.378 |
0 |
0 |
0 |
0.000 |
35 |
|
[ZN]A:393 |
1 |
1 |
98 |
f |
A |
-y,-x,-z-1/2 |
8_554 |
3 |
1 |
21576 |
10.6 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.054 |
36 |
|
[MG]A:1382 |
1 |
1 |
98 |
f |
[MG]A:1381 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.4 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.024 |
37 |
|
[MG]A:1381 |
1 |
1 |
98 |
f |
[SO4]A:1384 |
x,y,z |
1_555 |
1 |
1 |
186 |
0.5 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.001 |
|