## |
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 |
|
H |
168 |
51 |
12195 |
◊ |
L |
x,y,z |
1_555 |
186 |
52 |
11637 |
1615.4 |
-22.5 |
0.085 |
10 |
4 |
0 |
0.334 |
2 |
2 |
|
H |
103 |
34 |
12195 |
◊ |
H |
-x+2,y,-z |
2_755 |
105 |
35 |
12195 |
1009.5 |
-11.2 |
0.337 |
4 |
0 |
0 |
0.157 |
3 |
3 |
|
A |
63 |
13 |
2313 |
◊ |
H |
x,y,z |
1_555 |
87 |
22 |
12195 |
668.2 |
-7.0 |
0.639 |
8 |
3 |
0 |
0.336 |
4 |
4 |
|
L |
32 |
10 |
11637 |
x |
L |
-x+5/2,y-1/2,-z |
4_745 |
32 |
13 |
11637 |
292.5 |
1.8 |
0.827 |
5 |
1 |
0 |
0.000 |
5 |
5 |
|
H |
26 |
8 |
12195 |
◊ |
H |
-x+2,y,-z+1 |
2_756 |
26 |
8 |
12195 |
276.7 |
-4.7 |
0.211 |
2 |
0 |
0 |
0.000 |
6 |
6 |
|
H |
27 |
8 |
12195 |
◊ |
L |
-x+5/2,y-1/2,-z+1 |
4_746 |
31 |
12 |
11637 |
251.3 |
-1.0 |
0.612 |
2 |
0 |
0 |
0.017 |
7 |
7 |
|
H |
23 |
6 |
12195 |
◊ |
L |
-x+5/2,y-1/2,-z |
4_745 |
30 |
9 |
11637 |
248.4 |
-1.0 |
0.575 |
1 |
0 |
0 |
0.000 |
8 |
8 |
|
A |
29 |
6 |
2313 |
◊ |
L |
x,y,z |
1_555 |
32 |
13 |
11637 |
245.5 |
-0.7 |
0.645 |
6 |
6 |
0 |
0.044 |
9 |
9 |
|
H |
19 |
6 |
12195 |
◊ |
L |
-x+2,y,-z |
2_755 |
25 |
9 |
11637 |
183.7 |
0.4 |
0.699 |
3 |
0 |
0 |
0.010 |
10 |
10 |
|
[PGE]H:303 |
10 |
1 |
335 |
◊ |
H |
x,y,z |
1_555 |
20 |
7 |
12195 |
142.5 |
2.4 |
0.154 |
2 |
0 |
0 |
0.000 |
11 |
11 |
|
A |
16 |
4 |
2313 |
◊ |
L |
-x+5/2,y-1/2,-z |
4_745 |
17 |
7 |
11637 |
139.9 |
-2.8 |
0.440 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
A |
10 |
3 |
2313 |
◊ |
H |
-x+2,y,-z |
2_755 |
12 |
5 |
12195 |
123.5 |
-2.5 |
0.399 |
0 |
0 |
0 |
0.061 |
13 |
13 |
|
L |
12 |
6 |
11637 |
x |
L |
-x+5/2,y-1/2,-z+1 |
4_746 |
8 |
3 |
11637 |
112.8 |
-0.5 |
0.527 |
2 |
0 |
0 |
0.000 |
14 |
14 |
|
[SO4]H:301 |
5 |
1 |
187 |
f |
H |
x,y,z |
1_555 |
16 |
5 |
12195 |
86.8 |
-12.3 |
0.779 |
1 |
0 |
0 |
0.387 |
15 |
15 |
|
H |
17 |
7 |
12195 |
f |
[SO4]L:301 |
-x+5/2,y-1/2,-z+1 |
4_746 |
5 |
1 |
185 |
70.9 |
-8.7 |
0.815 |
2 |
0 |
0 |
0.292 |
16 |
16 |
|
[PGE]H:303 |
6 |
1 |
335 |
◊ |
L |
x,y,z |
1_555 |
11 |
4 |
11637 |
67.8 |
2.5 |
0.321 |
0 |
0 |
0 |
0.000 |
17 |
17 |
|
[SO4]L:304 |
5 |
1 |
186 |
f |
L |
x,y,z |
1_555 |
11 |
4 |
11637 |
66.0 |
-8.5 |
0.755 |
1 |
0 |
0 |
0.221 |
18 |
18 |
|
[NA]L:307 |
1 |
1 |
125 |
◊ |
L |
x,y,z |
1_555 |
10 |
4 |
11637 |
58.4 |
-7.6 |
0.000 |
0 |
0 |
0 |
0.153 |
19 |
19 |
|
[SO4]H:301 |
4 |
1 |
187 |
◊ |
L |
-x+2,y,-z |
2_755 |
9 |
4 |
11637 |
57.1 |
-7.3 |
0.762 |
2 |
0 |
0 |
0.087 |
20 |
20 |
|
[NA]L:306 |
1 |
1 |
125 |
f |
L |
x,y,z |
1_555 |
10 |
6 |
11637 |
57.0 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.182 |
21 |
21 |
|
L |
6 |
3 |
11637 |
f |
[SO4]L:302 |
-x+5/2,y-1/2,-z |
4_745 |
4 |
1 |
186 |
56.8 |
-8.3 |
0.489 |
1 |
0 |
0 |
0.216 |
22 |
22 |
|
[SO4]L:303 |
4 |
1 |
185 |
f |
L |
x,y,z |
1_555 |
6 |
3 |
11637 |
56.1 |
-6.7 |
0.900 |
3 |
0 |
0 |
0.198 |
23 |
23 |
|
H |
4 |
2 |
12195 |
◊ |
L |
x,y,z-1 |
1_554 |
4 |
2 |
11637 |
51.6 |
-0.8 |
0.299 |
0 |
0 |
0 |
0.000 |
24 |
24 |
|
[SO4]L:301 |
4 |
1 |
185 |
◊ |
L |
x,y,z |
1_555 |
9 |
4 |
11637 |
48.9 |
-6.5 |
0.722 |
1 |
0 |
0 |
0.062 |
25 |
25 |
|
H |
12 |
5 |
12195 |
◊ |
[NA]L:305 |
-x+5/2,y-1/2,-z+1 |
4_746 |
1 |
1 |
125 |
48.0 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.118 |
26 |
26 |
|
[NA]H:302 |
1 |
1 |
125 |
◊ |
H |
x,y,z |
1_555 |
9 |
5 |
12195 |
47.1 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.132 |
27 |
27 |
|
L |
5 |
3 |
11637 |
x |
L |
x,y,z-1 |
1_554 |
5 |
3 |
11637 |
46.3 |
1.3 |
0.880 |
0 |
0 |
0 |
0.000 |
28 |
28 |
|
[NA]L:307 |
1 |
1 |
125 |
◊ |
[SO4]L:304 |
x,y,z |
1_555 |
3 |
1 |
186 |
42.6 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.178 |
29 |
|
[NA]L:305 |
1 |
1 |
125 |
◊ |
[SO4]L:301 |
x,y,z |
1_555 |
4 |
1 |
185 |
27.6 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.178 |
Average: |
35.1 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.178 |
29 |
30 |
|
L |
7 |
3 |
11637 |
◊ |
[NA]L:306 |
-x+5/2,y-1/2,-z |
4_745 |
1 |
1 |
125 |
39.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.000 |
30 |
31 |
|
[SO4]L:302 |
4 |
1 |
186 |
◊ |
L |
x,y,z |
1_555 |
4 |
2 |
11637 |
39.0 |
-4.0 |
0.907 |
2 |
0 |
0 |
0.000 |
31 |
32 |
|
[NA]H:302 |
1 |
1 |
125 |
◊ |
[SO4]L:301 |
-x+5/2,y-1/2,-z+1 |
4_746 |
4 |
1 |
185 |
28.9 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.124 |
32 |
33 |
|
[NA]L:305 |
1 |
1 |
125 |
◊ |
L |
x,y,z |
1_555 |
6 |
3 |
11637 |
26.0 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.068 |
33 |
34 |
|
[PGE]H:303 |
3 |
1 |
335 |
f |
H |
-x+2,y,-z |
2_755 |
3 |
2 |
12195 |
25.4 |
0.5 |
0.274 |
0 |
0 |
0 |
0.000 |
34 |
35 |
|
H |
3 |
1 |
12195 |
◊ |
L |
-x+2,y,-z+1 |
2_756 |
4 |
2 |
11637 |
21.7 |
0.2 |
0.710 |
0 |
0 |
0 |
0.000 |
35 |
36 |
|
[NA]H:302 |
1 |
1 |
125 |
f |
[NA]L:305 |
-x+5/2,y-1/2,-z+1 |
4_746 |
1 |
1 |
125 |
15.9 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.100 |
36 |
37 |
|
[NA]H:302 |
1 |
1 |
125 |
◊ |
L |
-x+5/2,y-1/2,-z+1 |
4_746 |
6 |
2 |
11637 |
14.5 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.037 |
37 |
38 |
|
[SO4]H:301 |
1 |
1 |
187 |
◊ |
H |
-x+2,y,-z |
2_755 |
1 |
1 |
12195 |
7.7 |
-0.8 |
0.801 |
0 |
0 |
0 |
0.020 |
38 |
39 |
|
H |
1 |
1 |
12195 |
◊ |
L |
x,y-1,z |
1_545 |
3 |
2 |
11637 |
7.6 |
0.3 |
0.762 |
0 |
0 |
0 |
0.000 |
39 |
40 |
|
[NA]L:306 |
1 |
1 |
125 |
◊ |
[SO4]L:302 |
x,y,z |
1_555 |
1 |
1 |
186 |
3.5 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
|