| ## |
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 |
173 |
42 |
8608 |
◊ |
A |
x,y,z |
1_555 |
176 |
45 |
8711 |
1703.0 |
-18.3 |
0.160 |
18 |
12 |
0 |
0.300 |
| 2 |
2 |
|
B |
53 |
15 |
8608 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
53 |
15 |
8608 |
503.3 |
-4.3 |
0.331 |
8 |
10 |
0 |
0.045 |
| 3 |
3 |
|
B |
42 |
13 |
8608 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
34 |
11 |
8711 |
437.1 |
0.0 |
0.671 |
9 |
7 |
0 |
0.048 |
| 4 |
4 |
|
A |
37 |
15 |
8711 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
37 |
15 |
8711 |
315.6 |
-1.5 |
0.614 |
2 |
0 |
0 |
0.000 |
| 5 |
5 |
|
B |
27 |
5 |
8608 |
◊ |
B |
-x,y,-z+1/2 |
3_555 |
27 |
5 |
8608 |
232.2 |
4.8 |
0.927 |
6 |
0 |
0 |
0.000 |
| 6 |
6 |
|
A |
21 |
5 |
8711 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
26 |
8 |
8608 |
222.0 |
1.5 |
0.771 |
3 |
7 |
0 |
0.000 |
| 7 |
7 |
|
[MPD]A:154 |
7 |
1 |
273 |
f |
A |
x,y,z |
1_555 |
15 |
7 |
8711 |
116.7 |
-6.6 |
0.815 |
2 |
0 |
0 |
0.081 |
| 8 |
8 |
|
B |
10 |
4 |
8608 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
16 |
8 |
8711 |
113.0 |
1.3 |
0.762 |
0 |
1 |
0 |
0.000 |
| 9 |
9 |
|
[SO4]B:154 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
8608 |
99.3 |
-16.1 |
0.814 |
4 |
0 |
0 |
0.191 |
| 10 |
10 |
|
[SO4]B:153 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
8608 |
90.9 |
-13.1 |
0.852 |
4 |
0 |
0 |
0.159 |
| 11 |
11 |
|
A |
13 |
4 |
8711 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
8_456 |
10 |
3 |
8608 |
89.0 |
1.2 |
0.787 |
1 |
2 |
0 |
0.000 |
| 12 |
12 |
|
A |
11 |
4 |
8711 |
◊ |
A |
-x+1,y,-z+1/2 |
3_655 |
11 |
4 |
8711 |
81.8 |
0.9 |
0.789 |
2 |
4 |
0 |
0.003 |
| 13 |
13 |
|
[MPD]A:154 |
5 |
1 |
273 |
◊ |
B |
x,y,z |
1_555 |
13 |
4 |
8608 |
70.9 |
-3.0 |
0.000 |
2 |
0 |
0 |
0.042 |
| 14 |
14 |
|
[CL]A:153 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
8711 |
68.2 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.195 |
15 |
|
[CL]B:155 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
14 |
8 |
8608 |
65.9 |
-7.8 |
0.000 |
0 |
0 |
0 |
0.195 |
| Average: |
67.0 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.195 |
| 15 |
16 |
|
B |
9 |
2 |
8608 |
◊ |
A |
x-1/2,y+1/2,z |
5_455 |
5 |
3 |
8711 |
66.9 |
-0.7 |
0.385 |
0 |
0 |
0 |
0.000 |
| 16 |
17 |
|
A |
7 |
4 |
8711 |
◊ |
B |
x-1/2,y-1/2,z |
5_445 |
10 |
3 |
8608 |
66.7 |
-0.9 |
0.396 |
0 |
0 |
0 |
0.000 |
| 17 |
18 |
|
B |
6 |
2 |
8608 |
x |
B |
x-1/2,-y+1/2,-z+1 |
8_456 |
10 |
3 |
8608 |
55.2 |
-0.6 |
0.487 |
0 |
0 |
0 |
0.000 |
| 18 |
19 |
|
[MPD]A:154 |
3 |
1 |
273 |
◊ |
B |
-x,y,-z+1/2 |
3_555 |
3 |
1 |
8608 |
35.6 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 19 |
20 |
|
A |
4 |
2 |
8711 |
◊ |
B |
-x+1/2,-y+1/2,z-1/2 |
6_554 |
3 |
2 |
8608 |
29.8 |
0.8 |
0.639 |
0 |
0 |
0 |
0.000 |
| 20 |
21 |
|
[SO4]B:154 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
8711 |
24.4 |
-3.0 |
0.821 |
0 |
0 |
0 |
0.032 |
| 21 |
22 |
|
[MPD]A:154 |
3 |
1 |
273 |
◊ |
A |
-x,y,-z+1/2 |
3_555 |
2 |
2 |
8711 |
21.5 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 22 |
23 |
|
A |
1 |
1 |
8711 |
x |
A |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
1 |
1 |
8711 |
11.0 |
0.5 |
0.892 |
0 |
0 |
0 |
0.000 |
| 23 |
24 |
|
[SO4]B:153 |
1 |
1 |
184 |
◊ |
B |
-x+1,y,-z+1/2 |
3_655 |
1 |
1 |
8608 |
6.9 |
-0.7 |
0.802 |
0 |
0 |
0 |
0.007 |
| 24 |
25 |
|
[MPD]A:154 |
1 |
1 |
273 |
◊ |
[MPD]A:154 |
-x,y,-z+1/2 |
3_555 |
1 |
1 |
273 |
5.2 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
|