| ## |
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 |
116 |
40 |
19045 |
◊ |
A |
-y,-x,-z+1/2 |
8_555 |
114 |
40 |
19045 |
1079.1 |
-6.1 |
0.500 |
18 |
4 |
0 |
0.000 |
2 |
|
A |
70 |
24 |
19045 |
x |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
78 |
22 |
19045 |
789.7 |
-6.9 |
0.259 |
6 |
6 |
0 |
0.000 |
3 |
|
A |
74 |
26 |
19045 |
x |
A |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
68 |
22 |
19045 |
659.0 |
-4.7 |
0.367 |
6 |
2 |
0 |
0.000 |
4 |
|
A |
15 |
7 |
19045 |
x |
A |
-y,-x+1,-z+1/2 |
8_565 |
16 |
5 |
19045 |
142.4 |
-0.6 |
0.563 |
0 |
1 |
0 |
0.000 |
5 |
|
[DMS]A:511 |
4 |
1 |
212 |
f |
A |
x,y,z |
1_555 |
25 |
8 |
19045 |
133.9 |
2.5 |
0.509 |
1 |
0 |
0 |
0.000 |
6 |
|
[DMS]A:505 |
4 |
1 |
213 |
◊ |
A |
x,y,z |
1_555 |
18 |
8 |
19045 |
129.0 |
3.7 |
0.594 |
4 |
0 |
0 |
0.000 |
7 |
|
[LMR]A:504 |
9 |
1 |
260 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
19045 |
126.1 |
-2.9 |
0.559 |
6 |
0 |
0 |
0.007 |
8 |
|
[IMD]A:502 |
5 |
1 |
198 |
f |
A |
x,y,z |
1_555 |
21 |
6 |
19045 |
117.7 |
3.8 |
0.475 |
0 |
0 |
0 |
0.000 |
9 |
|
A |
12 |
3 |
19045 |
x |
A |
x-1,y,z |
1_455 |
16 |
5 |
19045 |
112.9 |
-1.7 |
0.277 |
0 |
0 |
0 |
0.000 |
10 |
|
[DMS]A:510 |
4 |
1 |
212 |
f |
A |
x,y,z |
1_555 |
22 |
8 |
19045 |
108.9 |
1.2 |
0.388 |
2 |
0 |
0 |
0.000 |
11 |
|
[IMD]A:503 |
5 |
1 |
199 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
19045 |
106.4 |
4.2 |
0.417 |
2 |
0 |
0 |
0.000 |
12 |
|
[MPD]A:509 |
7 |
1 |
265 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
19045 |
102.5 |
-6.1 |
0.000 |
1 |
0 |
0 |
0.008 |
13 |
|
A |
14 |
3 |
19045 |
◊ |
A |
y,x,-z |
7_555 |
14 |
3 |
19045 |
100.0 |
-1.1 |
0.442 |
2 |
0 |
0 |
0.000 |
14 |
|
[SO4]A:507 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
19045 |
94.4 |
-10.7 |
0.906 |
5 |
0 |
0 |
0.016 |
15 |
|
[LI]A:514 |
1 |
1 |
130 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
19045 |
72.1 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.007 |
16 |
|
[MPD]A:508 |
4 |
1 |
279 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
19045 |
71.5 |
-3.9 |
0.805 |
0 |
0 |
0 |
0.005 |
17 |
|
A |
13 |
5 |
19045 |
f |
[SO4]A:506 |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
5 |
1 |
184 |
69.9 |
-10.1 |
0.737 |
1 |
0 |
0 |
0.013 |
18 |
|
A |
10 |
4 |
19045 |
◊ |
[SO4]A:507 |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
5 |
1 |
186 |
67.0 |
-9.6 |
0.629 |
2 |
0 |
0 |
0.000 |
19 |
|
[LI]A:512 |
1 |
1 |
130 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
19045 |
66.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.005 |
20 |
|
[LI]A:513 |
1 |
1 |
130 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
19045 |
61.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.005 |
21 |
|
[MPD]A:508 |
4 |
1 |
279 |
◊ |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
5 |
2 |
19045 |
56.8 |
-3.0 |
0.758 |
0 |
0 |
0 |
0.000 |
22 |
|
[LMR]A:504 |
4 |
1 |
260 |
f |
[IMD]A:502 |
x,y,z |
1_555 |
5 |
1 |
198 |
36.7 |
0.8 |
0.078 |
0 |
0 |
0 |
0.000 |
23 |
|
[ZN]A:501 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
19045 |
36.2 |
-25.1 |
0.000 |
0 |
0 |
0 |
0.031 |
24 |
|
[SO4]A:506 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
19045 |
34.8 |
-3.8 |
0.964 |
1 |
0 |
0 |
0.000 |
25 |
|
[LI]A:513 |
1 |
1 |
130 |
◊ |
A |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
2 |
2 |
19045 |
34.4 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
26 |
|
[LMR]A:504 |
3 |
1 |
260 |
f |
[IMD]A:503 |
x,y,z |
1_555 |
3 |
1 |
199 |
34.2 |
0.2 |
0.183 |
1 |
0 |
0 |
0.000 |
27 |
|
[MPD]A:509 |
3 |
1 |
265 |
◊ |
A |
x-1/2,-y+1/2,-z+1/4 |
6_455 |
4 |
2 |
19045 |
33.8 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
28 |
|
[LMR]A:504 |
5 |
1 |
260 |
f |
[ZN]A:501 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.1 |
-14.5 |
0.000 |
0 |
0 |
0 |
0.018 |
29 |
|
[LI]A:512 |
1 |
1 |
130 |
◊ |
A |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
4 |
3 |
19045 |
24.5 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
30 |
|
[IMD]A:503 |
4 |
1 |
199 |
f |
[IMD]A:502 |
x,y,z |
1_555 |
2 |
1 |
198 |
22.5 |
1.4 |
0.053 |
0 |
0 |
0 |
0.000 |
31 |
|
[DMS]A:510 |
1 |
1 |
212 |
◊ |
A |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
2 |
2 |
19045 |
18.5 |
0.8 |
0.631 |
0 |
0 |
0 |
0.000 |
32 |
|
[DMS]A:505 |
1 |
1 |
213 |
f |
A |
-y,-x,-z+1/2 |
8_555 |
1 |
1 |
19045 |
10.4 |
0.5 |
0.656 |
0 |
0 |
0 |
0.000 |
33 |
|
[LI]A:512 |
1 |
1 |
130 |
f |
[DMS]A:510 |
x,y,z |
1_555 |
1 |
1 |
212 |
7.1 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.000 |
34 |
|
[MPD]A:508 |
1 |
1 |
279 |
◊ |
A |
x-1/2,-y-1/2,-z+1/4 |
6_445 |
1 |
1 |
19045 |
1.8 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|