| ## |
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 |
157 |
47 |
15113 |
◊ |
A |
-x,-y+1,z |
2_565 |
148 |
45 |
15100 |
1554.0 |
-32.5 |
0.534 |
6 |
0 |
0 |
0.841 |
| 2 |
2 |
|
B |
145 |
40 |
15113 |
◊ |
A |
x,y,z |
1_555 |
143 |
44 |
15100 |
1524.1 |
-35.4 |
0.294 |
8 |
0 |
0 |
0.817 |
3 |
|
D |
157 |
47 |
15073 |
◊ |
C |
-x,-y+1,z |
2_565 |
133 |
36 |
14596 |
1508.7 |
-34.8 |
0.350 |
6 |
0 |
0 |
0.817 |
4 |
|
D |
132 |
38 |
15073 |
◊ |
C |
x,y,z |
1_555 |
141 |
43 |
14596 |
1417.4 |
-31.2 |
0.414 |
10 |
0 |
0 |
0.817 |
| Average: |
1483.4 |
-33.8 |
0.353 |
8 |
0 |
0 |
0.817 |
| 3 |
5 |
|
D |
43 |
10 |
15073 |
◊ |
B |
-y,x+1,z+1/2 |
3_565 |
42 |
12 |
15113 |
443.9 |
-5.0 |
0.833 |
1 |
0 |
0 |
0.000 |
| 4 |
6 |
|
[PX4]C:1301 |
18 |
1 |
574 |
f |
C |
x,y,z |
1_555 |
44 |
11 |
14596 |
249.6 |
-4.1 |
0.252 |
0 |
0 |
0 |
0.046 |
| 5 |
7 |
|
D |
29 |
7 |
15073 |
◊ |
A |
x,y,z |
1_555 |
29 |
8 |
15100 |
237.9 |
1.6 |
0.977 |
3 |
5 |
0 |
0.000 |
8 |
|
C |
17 |
7 |
14596 |
◊ |
B |
x,y,z |
1_555 |
24 |
8 |
15113 |
183.5 |
-1.5 |
0.846 |
1 |
1 |
0 |
0.000 |
| Average: |
210.7 |
0.0 |
0.912 |
2 |
3 |
0 |
0.000 |
| 6 |
9 |
|
[PX4]C:1301 |
16 |
1 |
574 |
◊ |
D |
x,y,z |
1_555 |
20 |
6 |
15073 |
150.0 |
0.4 |
0.472 |
0 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[PX4]A:1301 |
11 |
1 |
407 |
◊ |
A |
x,y,z |
1_555 |
26 |
6 |
15100 |
140.4 |
1.4 |
0.274 |
1 |
0 |
0 |
0.000 |
| 8 |
11 |
|
A |
16 |
7 |
15100 |
◊ |
C |
-y+1,x,z-1/2 |
3_654 |
14 |
7 |
14596 |
134.1 |
-1.1 |
0.769 |
0 |
0 |
0 |
0.000 |
| 9 |
12 |
|
[PX4]A:1301 |
10 |
1 |
407 |
f |
B |
x,y,z |
1_555 |
17 |
5 |
15113 |
122.7 |
0.8 |
0.211 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
[PX4]B:1302 |
5 |
1 |
222 |
◊ |
A |
-x,-y+1,z |
2_565 |
16 |
6 |
15100 |
92.7 |
0.5 |
0.437 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[PX4]B:1301 |
7 |
1 |
288 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
15113 |
84.5 |
-0.1 |
0.500 |
0 |
0 |
0 |
0.003 |
| 12 |
15 |
|
[PO4]C:1302 |
5 |
1 |
188 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
15073 |
81.4 |
-5.4 |
0.662 |
0 |
0 |
0 |
0.092 |
| 13 |
16 |
|
[PX4]D:1301 |
7 |
1 |
271 |
◊ |
C |
-x,-y+1,z |
2_565 |
9 |
3 |
14596 |
80.1 |
0.5 |
0.424 |
0 |
0 |
0 |
0.000 |
| 14 |
17 |
|
D |
11 |
3 |
15073 |
◊ |
B |
x,y,z |
1_555 |
8 |
2 |
15113 |
74.4 |
0.1 |
0.874 |
0 |
0 |
0 |
0.000 |
18 |
|
C |
8 |
1 |
14596 |
◊ |
A |
-x,-y+1,z |
2_565 |
7 |
1 |
15100 |
62.0 |
0.0 |
0.846 |
0 |
0 |
0 |
0.000 |
| Average: |
68.2 |
0.0 |
0.860 |
0 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[PO4]B:1303 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
15113 |
69.3 |
-4.7 |
0.708 |
0 |
0 |
0 |
0.118 |
| 16 |
20 |
|
[PO4]D:1302 |
4 |
1 |
188 |
f |
C |
-x,-y+1,z |
2_565 |
12 |
4 |
14596 |
65.5 |
-4.4 |
0.865 |
1 |
0 |
0 |
0.054 |
| 17 |
21 |
|
[PX4]B:1301 |
7 |
1 |
288 |
◊ |
A |
-x,-y+1,z |
2_565 |
12 |
3 |
15100 |
60.4 |
0.7 |
0.574 |
1 |
0 |
0 |
0.000 |
| 18 |
22 |
|
B |
4 |
2 |
15113 |
◊ |
B |
-x,-y+1,z |
2_565 |
4 |
2 |
15113 |
55.0 |
-1.8 |
0.222 |
0 |
0 |
0 |
0.011 |
| 19 |
23 |
|
[PO4]A:1302 |
4 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
15100 |
52.0 |
-3.0 |
0.893 |
1 |
0 |
0 |
0.100 |
| 20 |
24 |
|
[PO4]D:1302 |
4 |
1 |
188 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
15073 |
52.0 |
-2.8 |
0.841 |
0 |
0 |
0 |
0.031 |
| 21 |
25 |
|
[PO4]C:1302 |
4 |
1 |
188 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
14596 |
33.1 |
-2.2 |
0.587 |
0 |
0 |
0 |
0.023 |
| 22 |
26 |
|
D |
4 |
2 |
15073 |
◊ |
B |
-x,-y+1,z |
2_565 |
4 |
2 |
15113 |
25.8 |
0.7 |
0.910 |
1 |
1 |
0 |
0.000 |
| 23 |
27 |
|
[PO4]B:1303 |
3 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
15100 |
23.6 |
-1.6 |
0.675 |
0 |
0 |
0 |
0.034 |
| 24 |
28 |
|
[PX4]D:1301 |
5 |
1 |
271 |
f |
D |
x,y,z |
1_555 |
3 |
2 |
15073 |
21.7 |
-0.4 |
0.284 |
0 |
0 |
0 |
0.008 |
| 25 |
29 |
|
C |
3 |
1 |
14596 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
15100 |
13.3 |
0.3 |
0.840 |
0 |
0 |
0 |
0.000 |
| 26 |
30 |
|
[PO4]A:1302 |
4 |
1 |
189 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
15113 |
11.6 |
-0.6 |
0.740 |
0 |
0 |
0 |
0.012 |
| 27 |
31 |
|
[PX4]B:1302 |
1 |
1 |
222 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
15113 |
1.6 |
0.0 |
0.312 |
0 |
0 |
0 |
0.000 |
|