| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
B |
169 |
42 |
13146 |
◊ |
A |
x,y,z |
1_555 |
164 |
42 |
13072 |
1549.3 |
-14.3 |
0.134 |
9 |
0 |
0 |
0.159 |
| 2 |
2 |
|
A |
60 |
20 |
13072 |
◊ |
B |
-x-1,y-1/2,-z-1 |
2_444 |
53 |
17 |
13146 |
435.6 |
-2.1 |
0.469 |
0 |
1 |
0 |
0.000 |
| 3 |
3 |
|
A |
44 |
12 |
13072 |
◊ |
B |
x-1,y,z |
1_455 |
41 |
11 |
13146 |
380.6 |
-0.3 |
0.544 |
5 |
2 |
0 |
0.000 |
| 4 |
4 |
|
[TSN]B:2002 |
22 |
1 |
546 |
f |
B |
x,y,z |
1_555 |
46 |
18 |
13146 |
293.7 |
-1.5 |
0.250 |
3 |
0 |
0 |
0.046 |
5 |
|
[TSN]A:2002 |
22 |
1 |
543 |
f |
A |
x,y,z |
1_555 |
44 |
16 |
13072 |
283.4 |
-1.1 |
0.268 |
3 |
0 |
0 |
0.046 |
| Average: |
288.6 |
-1.3 |
0.259 |
3 |
0 |
0 |
0.046 |
| 5 |
6 |
|
A |
33 |
11 |
13072 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
30 |
10 |
13146 |
287.6 |
0.8 |
0.734 |
3 |
0 |
0 |
0.000 |
| 6 |
7 |
|
B |
25 |
9 |
13146 |
◊ |
A |
x,y,z-1 |
1_554 |
21 |
8 |
13072 |
183.7 |
0.5 |
0.634 |
1 |
0 |
0 |
0.000 |
| 7 |
8 |
|
A |
22 |
9 |
13072 |
◊ |
B |
-x,y-1/2,-z-1 |
2_544 |
17 |
6 |
13146 |
163.3 |
-2.2 |
0.278 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[TSN]A:2002 |
12 |
1 |
543 |
◊ |
B |
-x-1,y-1/2,-z-1 |
2_444 |
22 |
7 |
13146 |
146.4 |
-0.3 |
0.438 |
0 |
0 |
0 |
0.000 |
10 |
|
A |
23 |
7 |
13072 |
◊ |
[TSN]B:2002 |
-x-1,y-1/2,-z-1 |
2_444 |
12 |
1 |
546 |
141.4 |
-0.4 |
0.431 |
0 |
0 |
0 |
0.000 |
| Average: |
143.9 |
-0.4 |
0.435 |
0 |
0 |
0 |
0.000 |
| 9 |
11 |
|
[EDO]A:2006 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
20 |
9 |
13072 |
107.4 |
3.3 |
0.509 |
3 |
0 |
0 |
0.000 |
| 10 |
12 |
|
[EDO]B:2005 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
13146 |
94.5 |
2.8 |
0.479 |
2 |
0 |
0 |
0.000 |
| 11 |
13 |
|
B |
6 |
2 |
13146 |
x |
B |
x-1,y,z |
1_455 |
12 |
4 |
13146 |
92.3 |
0.6 |
0.709 |
2 |
2 |
0 |
0.000 |
| 12 |
14 |
|
[SO4]A:2005 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
13072 |
80.0 |
-10.2 |
0.924 |
3 |
0 |
0 |
0.100 |
| 13 |
15 |
|
[SO4]A:2005 |
4 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
13146 |
72.2 |
-9.4 |
0.885 |
2 |
0 |
0 |
0.090 |
| 14 |
16 |
|
[NH4]A:2004 |
1 |
1 |
117 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
13072 |
67.2 |
1.3 |
0.794 |
0 |
0 |
0 |
0.000 |
17 |
|
[NH4]B:2004 |
1 |
1 |
117 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
13146 |
65.4 |
1.3 |
0.787 |
0 |
0 |
0 |
0.000 |
| Average: |
66.3 |
1.3 |
0.790 |
0 |
0 |
0 |
0.000 |
| 15 |
18 |
|
[EDO]B:2005 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
13072 |
41.2 |
2.0 |
0.941 |
0 |
0 |
0 |
0.000 |
| 16 |
19 |
|
[ZN]B:2001 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
6 |
13146 |
35.7 |
-25.8 |
0.000 |
0 |
0 |
0 |
0.443 |
20 |
|
[ZN]A:2001 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
7 |
13072 |
35.0 |
-25.1 |
0.000 |
0 |
0 |
0 |
0.443 |
| Average: |
35.3 |
-25.4 |
0.000 |
0 |
0 |
0 |
0.443 |
| 17 |
21 |
|
[TSN]A:2002 |
4 |
1 |
543 |
cf |
[ZN]A:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.8 |
-14.0 |
0.000 |
0 |
0 |
0 |
0.237 |
22 |
|
[TSN]B:2002 |
4 |
1 |
546 |
f |
[ZN]B:2001 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.9 |
-13.1 |
0.000 |
0 |
0 |
0 |
0.237 |
| Average: |
30.4 |
-13.6 |
0.000 |
0 |
0 |
0 |
0.237 |
| 18 |
23 |
|
A |
2 |
1 |
13072 |
x |
A |
x,y,z-1 |
1_554 |
1 |
1 |
13072 |
6.8 |
-0.1 |
0.419 |
0 |
0 |
0 |
0.000 |
| 19 |
24 |
|
[EDO]A:2006 |
1 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
13146 |
1.5 |
0.1 |
0.846 |
0 |
0 |
0 |
0.000 |
|