## |
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 |
155 |
16 |
3277 |
◊ |
X |
x,y,z |
1_555 |
159 |
51 |
14223 |
1258.9 |
-16.8 |
0.377 |
21 |
0 |
0 |
0.511 |
2 |
|
B |
102 |
15 |
3222 |
◊ |
X |
x,y,z |
1_555 |
88 |
29 |
14223 |
791.5 |
-4.6 |
0.599 |
9 |
0 |
0 |
0.124 |
3 |
|
B |
75 |
22 |
3222 |
◊ |
A |
x,y,z |
1_555 |
76 |
22 |
3277 |
656.4 |
5.8 |
0.938 |
38 |
0 |
0 |
0.962 |
4 |
|
X |
32 |
11 |
14223 |
x |
X |
x,y-1,z |
1_545 |
41 |
14 |
14223 |
373.1 |
-3.8 |
0.249 |
0 |
0 |
0 |
0.000 |
5 |
|
X |
35 |
11 |
14223 |
x |
X |
-x+1,y-1/2,-z+1 |
2_646 |
41 |
10 |
14223 |
325.6 |
-0.0 |
0.634 |
1 |
1 |
0 |
0.000 |
6 |
|
X |
38 |
14 |
14223 |
x |
X |
-x,y-1/2,-z |
2_545 |
38 |
10 |
14223 |
312.1 |
0.3 |
0.648 |
0 |
0 |
0 |
0.000 |
7 |
|
X |
31 |
9 |
14223 |
x |
X |
x-1,y,z |
1_455 |
35 |
14 |
14223 |
303.6 |
-1.2 |
0.512 |
0 |
1 |
0 |
0.000 |
8 |
|
X |
32 |
8 |
14223 |
x |
X |
-x+1,y-1/2,-z |
2_645 |
30 |
9 |
14223 |
270.7 |
-3.6 |
0.199 |
1 |
0 |
0 |
0.000 |
9 |
|
X |
23 |
6 |
14223 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
26 |
4 |
3277 |
169.2 |
-2.2 |
0.234 |
0 |
0 |
0 |
0.000 |
10 |
|
B |
24 |
6 |
3222 |
◊ |
X |
x,y-1,z |
1_545 |
17 |
6 |
14223 |
153.9 |
-4.8 |
0.255 |
0 |
0 |
0 |
0.000 |
11 |
|
X |
16 |
7 |
14223 |
x |
X |
-x,y-1/2,-z+1 |
2_546 |
15 |
4 |
14223 |
128.5 |
-0.7 |
0.463 |
0 |
0 |
0 |
0.000 |
12 |
|
[EDO]X:802 |
4 |
1 |
183 |
◊ |
X |
x,y,z |
1_555 |
15 |
5 |
14223 |
92.9 |
3.1 |
0.306 |
0 |
0 |
0 |
0.000 |
13 |
|
[PO4]X:801 |
5 |
1 |
188 |
f |
X |
x,y,z |
1_555 |
15 |
7 |
14223 |
84.4 |
-5.0 |
0.775 |
0 |
0 |
0 |
0.097 |
14 |
|
[SO4]X:803 |
5 |
1 |
184 |
f |
X |
x,y,z |
1_555 |
16 |
5 |
14223 |
78.5 |
-9.8 |
0.857 |
4 |
0 |
0 |
0.227 |
15 |
|
B |
17 |
3 |
3222 |
◊ |
X |
-x,y-1/2,-z+1 |
2_546 |
12 |
3 |
14223 |
78.4 |
1.4 |
0.696 |
0 |
0 |
0 |
0.000 |
16 |
|
[SO4]X:805 |
5 |
1 |
185 |
f |
X |
x,y,z |
1_555 |
14 |
7 |
14223 |
76.5 |
-9.8 |
0.809 |
2 |
0 |
0 |
0.209 |
17 |
|
A |
17 |
2 |
3277 |
◊ |
X |
-x,y-1/2,-z+1 |
2_546 |
11 |
3 |
14223 |
74.0 |
0.7 |
0.695 |
0 |
0 |
0 |
0.000 |
18 |
|
[EDO]B:1801 |
4 |
1 |
184 |
◊ |
X |
x,y,z |
1_555 |
8 |
5 |
14223 |
73.6 |
2.0 |
0.893 |
1 |
0 |
0 |
0.000 |
19 |
|
[EDO]X:804 |
4 |
1 |
184 |
◊ |
X |
x,y,z |
1_555 |
10 |
4 |
14223 |
73.3 |
2.5 |
0.302 |
0 |
0 |
0 |
0.000 |
20 |
|
[EDO]B:1801 |
3 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
7 |
2 |
3222 |
61.5 |
0.1 |
0.142 |
0 |
0 |
0 |
0.000 |
21 |
|
X |
7 |
3 |
14223 |
◊ |
[SO4]X:803 |
x,y-1,z |
1_545 |
4 |
1 |
184 |
56.4 |
-7.3 |
0.666 |
1 |
0 |
0 |
0.000 |
22 |
|
X |
6 |
2 |
14223 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
11 |
2 |
3222 |
49.7 |
0.5 |
0.682 |
0 |
0 |
0 |
0.000 |
23 |
|
[SO4]X:805 |
4 |
1 |
185 |
◊ |
X |
-x,y-1/2,-z |
2_545 |
5 |
2 |
14223 |
44.8 |
-5.4 |
0.837 |
0 |
0 |
0 |
0.000 |
24 |
|
X |
2 |
1 |
14223 |
◊ |
[PO4]X:801 |
-x+1,y-1/2,-z |
2_645 |
4 |
1 |
188 |
40.7 |
-1.4 |
0.927 |
1 |
0 |
0 |
0.000 |
25 |
|
A |
6 |
2 |
3277 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
4 |
3 |
3277 |
35.8 |
-1.2 |
0.316 |
0 |
0 |
0 |
0.000 |
26 |
|
X |
7 |
4 |
14223 |
◊ |
[SO4]X:805 |
-x,y-1/2,-z |
2_545 |
3 |
1 |
185 |
30.9 |
-3.4 |
0.807 |
0 |
0 |
0 |
0.000 |
27 |
|
X |
5 |
2 |
14223 |
◊ |
[EDO]X:802 |
x-1,y,z |
1_455 |
3 |
1 |
183 |
26.6 |
0.7 |
0.694 |
0 |
0 |
0 |
0.000 |
28 |
|
[EDO]X:804 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
3 |
1 |
3277 |
25.7 |
-0.5 |
0.430 |
0 |
0 |
0 |
0.100 |
29 |
|
[EDO]X:802 |
2 |
1 |
183 |
f |
X |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
2 |
14223 |
23.7 |
0.2 |
0.740 |
0 |
0 |
0 |
0.000 |
30 |
|
[SO4]X:805 |
4 |
1 |
185 |
◊ |
[SO4]X:803 |
-x,y-1/2,-z |
2_545 |
4 |
1 |
184 |
17.9 |
-3.8 |
0.998 |
0 |
0 |
0 |
0.000 |
31 |
|
X |
1 |
1 |
14223 |
◊ |
[SO4]X:803 |
-x,y-1/2,-z |
2_545 |
2 |
1 |
184 |
12.6 |
-1.3 |
0.906 |
0 |
0 |
0 |
0.000 |
32 |
|
X |
1 |
1 |
14223 |
◊ |
B |
x,y-1,z |
1_545 |
1 |
1 |
3222 |
3.8 |
-0.3 |
0.265 |
0 |
0 |
0 |
0.000 |
33 |
|
X |
1 |
1 |
14223 |
◊ |
[EDO]X:804 |
-x,y-1/2,-z+1 |
2_546 |
1 |
1 |
184 |
2.0 |
0.0 |
0.672 |
0 |
0 |
0 |
0.000 |
|