| ## |
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 |
|
D |
106 |
26 |
11856 |
◊ |
A |
x,y,z |
1_555 |
103 |
27 |
11671 |
996.4 |
-0.4 |
0.805 |
16 |
6 |
0 |
0.133 |
2 |
|
C |
95 |
24 |
11754 |
◊ |
B |
x,y,z |
1_555 |
102 |
26 |
11810 |
994.7 |
-0.9 |
0.776 |
16 |
6 |
0 |
0.133 |
| Average: |
995.5 |
-0.7 |
0.791 |
16 |
6 |
0 |
0.133 |
| 2 |
3 |
|
B |
96 |
25 |
11810 |
◊ |
A |
x,y,z |
1_555 |
93 |
24 |
11671 |
942.7 |
-15.7 |
0.018 |
4 |
2 |
0 |
0.859 |
4 |
|
D |
99 |
24 |
11856 |
◊ |
C |
x,y,z |
1_555 |
95 |
24 |
11754 |
926.1 |
-15.3 |
0.025 |
4 |
2 |
0 |
0.859 |
| Average: |
934.4 |
-15.5 |
0.021 |
4 |
2 |
0 |
0.859 |
| 3 |
5 |
|
C |
37 |
11 |
11754 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
37 |
10 |
11810 |
322.7 |
0.8 |
0.783 |
6 |
1 |
0 |
0.000 |
6 |
|
D |
37 |
9 |
11856 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
35 |
11 |
11671 |
321.1 |
-0.8 |
0.580 |
6 |
0 |
0 |
0.000 |
| Average: |
321.9 |
0.0 |
0.682 |
6 |
1 |
0 |
0.000 |
| 4 |
7 |
|
A |
36 |
12 |
11671 |
◊ |
B |
x-1,y,z |
1_455 |
32 |
7 |
11810 |
307.5 |
-1.5 |
0.477 |
2 |
0 |
0 |
0.000 |
| 5 |
8 |
|
C |
27 |
9 |
11754 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
34 |
15 |
11671 |
252.7 |
-0.4 |
0.567 |
4 |
0 |
0 |
0.000 |
| 6 |
9 |
|
[MRD]D:304 |
7 |
1 |
276 |
f |
D |
x,y,z |
1_555 |
27 |
13 |
11856 |
195.4 |
2.3 |
0.379 |
0 |
0 |
0 |
0.000 |
| 7 |
10 |
|
[MRD]C:304 |
7 |
1 |
269 |
f |
C |
x,y,z |
1_555 |
29 |
14 |
11754 |
192.9 |
1.7 |
0.346 |
1 |
0 |
0 |
0.000 |
| 8 |
11 |
|
[MPD]B:306 |
7 |
1 |
278 |
f |
B |
x,y,z |
1_555 |
32 |
16 |
11810 |
192.2 |
-14.5 |
0.301 |
0 |
0 |
0 |
0.149 |
| 9 |
12 |
|
[MPD]B:304 |
7 |
1 |
271 |
f |
B |
x,y,z |
1_555 |
28 |
14 |
11810 |
191.7 |
-13.9 |
0.426 |
1 |
0 |
0 |
0.148 |
| 10 |
13 |
|
[MPD]A:304 |
7 |
1 |
269 |
f |
A |
x,y,z |
1_555 |
27 |
14 |
11671 |
190.6 |
-13.9 |
0.431 |
1 |
0 |
0 |
0.148 |
| 11 |
14 |
|
[MPD]B:305 |
7 |
1 |
274 |
f |
B |
x,y,z |
1_555 |
37 |
13 |
11810 |
181.2 |
-13.0 |
0.557 |
1 |
0 |
0 |
0.138 |
| 12 |
15 |
|
[MRD]D:305 |
7 |
1 |
273 |
f |
D |
x,y,z |
1_555 |
33 |
10 |
11856 |
177.9 |
0.6 |
0.307 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[MRD]C:305 |
7 |
1 |
273 |
f |
C |
x,y,z |
1_555 |
31 |
9 |
11754 |
166.3 |
1.6 |
0.372 |
0 |
0 |
0 |
0.000 |
| 14 |
17 |
|
[PO4]A:306 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
21 |
13 |
11671 |
131.4 |
-8.6 |
0.547 |
1 |
0 |
0 |
0.093 |
| 15 |
18 |
|
[MRD]A:305 |
6 |
1 |
274 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
11810 |
127.3 |
0.5 |
0.322 |
2 |
0 |
0 |
0.004 |
| 16 |
19 |
|
[MRD]C:306 |
5 |
1 |
269 |
f |
D |
x,y,z |
1_555 |
22 |
10 |
11856 |
124.7 |
0.7 |
0.352 |
0 |
0 |
0 |
0.000 |
| 17 |
20 |
|
[MRD]C:306 |
7 |
1 |
269 |
◊ |
C |
x,y,z |
1_555 |
16 |
8 |
11754 |
120.2 |
2.2 |
0.335 |
0 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[MRD]A:305 |
5 |
1 |
274 |
◊ |
A |
x,y,z |
1_555 |
17 |
8 |
11671 |
116.0 |
0.3 |
0.333 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
D |
15 |
6 |
11856 |
◊ |
B |
x,y,z |
1_555 |
13 |
6 |
11810 |
109.8 |
2.6 |
0.923 |
1 |
2 |
0 |
0.000 |
23 |
|
C |
11 |
6 |
11754 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
11671 |
70.5 |
2.5 |
0.941 |
0 |
1 |
0 |
0.000 |
| Average: |
90.1 |
2.5 |
0.932 |
1 |
2 |
0 |
0.000 |
| 20 |
24 |
|
[PO4]D:306 |
4 |
1 |
190 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
11856 |
74.7 |
-3.5 |
0.875 |
5 |
0 |
0 |
0.282 |
| 21 |
25 |
|
[PO4]A:307 |
4 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
11671 |
74.7 |
-3.4 |
0.877 |
4 |
0 |
0 |
0.054 |
| 22 |
26 |
|
[PO4]B:307 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
7 |
4 |
11810 |
74.7 |
-3.5 |
0.940 |
5 |
0 |
0 |
0.059 |
| 23 |
27 |
|
[PO4]C:307 |
4 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
11754 |
74.7 |
-3.5 |
0.874 |
5 |
0 |
0 |
0.285 |
| 24 |
28 |
|
[MPD]B:306 |
1 |
1 |
278 |
f |
[MPD]B:305 |
x,y,z |
1_555 |
2 |
1 |
274 |
19.3 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.019 |
| 25 |
29 |
|
[MPD]B:306 |
2 |
1 |
278 |
f |
[MPD]B:304 |
x,y,z |
1_555 |
1 |
1 |
271 |
8.1 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.008 |
|