## |
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 |
|
H |
136 |
39 |
11646 |
◊ |
L |
x,y,z |
1_555 |
108 |
26 |
3238 |
1169.0 |
-10.2 |
0.444 |
16 |
9 |
1 |
0.350 |
2 |
|
D |
55 |
10 |
1470 |
◊ |
H |
x,y,z |
1_555 |
64 |
17 |
11646 |
591.0 |
-5.4 |
0.576 |
3 |
0 |
0 |
0.014 |
3 |
|
[23U]H:301 |
30 |
1 |
696 |
f |
H |
x,y,z |
1_555 |
73 |
25 |
11646 |
449.7 |
-8.2 |
0.339 |
3 |
0 |
0 |
0.148 |
4 |
|
H |
38 |
10 |
11646 |
◊ |
H |
-x,y,-z |
2_555 |
38 |
10 |
11646 |
412.8 |
-0.3 |
0.547 |
1 |
2 |
0 |
0.000 |
5 |
|
H |
36 |
10 |
11646 |
x |
H |
-x+1/2,y-1/2,-z+1 |
4_546 |
27 |
8 |
11646 |
248.6 |
-1.6 |
0.292 |
0 |
0 |
0 |
0.000 |
6 |
|
L |
23 |
6 |
3238 |
◊ |
H |
x-1/2,y+1/2,z |
3_455 |
23 |
7 |
11646 |
205.8 |
0.2 |
0.729 |
1 |
2 |
0 |
0.000 |
7 |
|
L |
20 |
3 |
3238 |
◊ |
L |
-x,y,-z+1 |
2_556 |
20 |
3 |
3238 |
172.2 |
1.4 |
0.898 |
0 |
0 |
0 |
0.000 |
8 |
|
H |
16 |
5 |
11646 |
◊ |
L |
-x+1/2,y-1/2,-z+1 |
4_546 |
21 |
5 |
3238 |
171.6 |
1.2 |
0.801 |
2 |
0 |
0 |
0.000 |
9 |
|
[GOL]H:310 |
6 |
1 |
219 |
f |
H |
x,y,z |
1_555 |
16 |
8 |
11646 |
132.9 |
-0.5 |
0.526 |
2 |
0 |
0 |
0.021 |
10 |
|
H |
12 |
5 |
11646 |
◊ |
H |
-x+1,y,-z+1 |
2_656 |
12 |
5 |
11646 |
128.1 |
3.3 |
0.931 |
2 |
8 |
0 |
0.000 |
11 |
|
[DMS]H:302 |
4 |
1 |
207 |
f |
H |
x,y,z |
1_555 |
20 |
11 |
11646 |
125.4 |
1.9 |
0.450 |
1 |
0 |
0 |
0.000 |
12 |
|
[GOL]H:305 |
6 |
1 |
218 |
f |
H |
x,y,z |
1_555 |
16 |
9 |
11646 |
109.9 |
-0.5 |
0.488 |
4 |
0 |
0 |
0.035 |
13 |
|
[GOL]H:307 |
6 |
1 |
220 |
f |
H |
x,y,z |
1_555 |
16 |
5 |
11646 |
100.6 |
-0.1 |
0.581 |
2 |
0 |
0 |
0.015 |
14 |
|
[GOL]H:304 |
5 |
1 |
219 |
f |
H |
x,y,z |
1_555 |
18 |
5 |
11646 |
99.1 |
0.1 |
0.566 |
3 |
0 |
0 |
0.019 |
15 |
|
[GOL]H:306 |
6 |
1 |
220 |
f |
H |
x,y,z |
1_555 |
14 |
5 |
11646 |
92.2 |
1.2 |
0.713 |
4 |
0 |
0 |
0.008 |
16 |
|
[PO4]H:303 |
5 |
1 |
190 |
f |
H |
x,y,z |
1_555 |
13 |
6 |
11646 |
87.9 |
-4.3 |
0.893 |
4 |
0 |
0 |
0.094 |
17 |
|
[NA]H:308 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
19 |
11 |
11646 |
81.7 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.178 |
18 |
|
[NA]H:309 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
11 |
5 |
11646 |
57.7 |
-8.1 |
0.000 |
0 |
0 |
0 |
0.125 |
19 |
|
H |
7 |
3 |
11646 |
◊ |
H |
-x,y,-z+1 |
2_556 |
7 |
3 |
11646 |
55.0 |
-0.1 |
0.553 |
0 |
0 |
0 |
0.000 |
20 |
|
D |
4 |
1 |
1470 |
◊ |
H |
-x,y,-z |
2_555 |
7 |
4 |
11646 |
51.9 |
0.2 |
0.598 |
0 |
0 |
0 |
0.000 |
21 |
|
[GOL]H:310 |
3 |
1 |
219 |
f |
[23U]H:301 |
x,y,z |
1_555 |
5 |
1 |
696 |
45.1 |
-1.2 |
0.396 |
1 |
0 |
0 |
0.025 |
22 |
|
[23U]H:301 |
3 |
1 |
696 |
◊ |
L |
-x+1/2,y-1/2,-z+1 |
4_546 |
6 |
2 |
3238 |
39.9 |
1.6 |
0.815 |
0 |
0 |
0 |
0.000 |
23 |
|
[GOL]H:306 |
3 |
1 |
220 |
◊ |
H |
-x+1,y,-z+1 |
2_656 |
4 |
2 |
11646 |
39.8 |
0.7 |
0.670 |
0 |
0 |
0 |
0.000 |
24 |
|
[GOL]H:304 |
4 |
1 |
219 |
f |
[PO4]H:303 |
x,y,z |
1_555 |
4 |
1 |
190 |
38.6 |
-1.6 |
0.793 |
1 |
0 |
0 |
0.032 |
25 |
|
[NA]H:309 |
1 |
1 |
125 |
◊ |
H |
-x+1/2,y-1/2,-z+1 |
4_546 |
5 |
3 |
11646 |
37.8 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.000 |
26 |
|
[GOL]H:306 |
3 |
1 |
220 |
◊ |
[PO4]H:303 |
-x+1,y,-z+1 |
2_656 |
4 |
1 |
190 |
31.7 |
-1.4 |
0.668 |
1 |
0 |
0 |
0.000 |
27 |
|
[GOL]H:307 |
2 |
1 |
220 |
◊ |
H |
-x+1,y,-z+1 |
2_656 |
4 |
1 |
11646 |
31.5 |
0.6 |
0.720 |
0 |
0 |
0 |
0.000 |
28 |
|
[GOL]H:307 |
3 |
1 |
220 |
f |
[DMS]H:302 |
x,y,z |
1_555 |
2 |
1 |
207 |
29.4 |
0.6 |
0.612 |
0 |
0 |
0 |
0.000 |
29 |
|
[GOL]H:306 |
3 |
1 |
220 |
◊ |
[GOL]H:304 |
-x+1,y,-z+1 |
2_656 |
3 |
1 |
219 |
25.8 |
-0.0 |
0.535 |
0 |
0 |
0 |
0.000 |
30 |
|
[GOL]H:307 |
2 |
1 |
220 |
f |
[GOL]H:306 |
x,y,z |
1_555 |
3 |
1 |
220 |
23.2 |
0.2 |
0.612 |
0 |
0 |
0 |
0.000 |
31 |
|
[GOL]H:305 |
2 |
1 |
218 |
f |
[23U]H:301 |
x,y,z |
1_555 |
2 |
1 |
696 |
23.0 |
0.9 |
0.692 |
0 |
0 |
0 |
0.000 |
32 |
|
[PO4]H:303 |
2 |
1 |
190 |
◊ |
H |
-x+1,y,-z+1 |
2_656 |
2 |
2 |
11646 |
6.4 |
-0.1 |
0.893 |
0 |
0 |
0 |
0.000 |
33 |
|
[GOL]H:305 |
2 |
1 |
218 |
◊ |
H |
-x+1/2,y-1/2,-z+1 |
4_546 |
2 |
1 |
11646 |
3.5 |
-0.1 |
0.531 |
0 |
0 |
0 |
0.000 |
|