| ## |
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 |
63 |
15 |
18380 |
◊ |
A |
x,y,z |
1_555 |
68 |
18 |
18228 |
631.5 |
-13.8 |
0.008 |
0 |
1 |
0 |
0.328 |
| 2 |
2 |
|
B |
64 |
17 |
18380 |
◊ |
A |
-x+3,y-1/2,-z |
2_845 |
69 |
18 |
18228 |
580.7 |
-2.4 |
0.422 |
7 |
7 |
0 |
0.000 |
| 3 |
3 |
|
B |
54 |
17 |
18380 |
x |
B |
x-1,y,z |
1_455 |
53 |
17 |
18380 |
489.9 |
-4.5 |
0.236 |
4 |
0 |
0 |
0.000 |
| 4 |
4 |
|
B |
39 |
12 |
18380 |
x |
B |
-x+3,y-1/2,-z-1 |
2_844 |
46 |
12 |
18380 |
387.2 |
3.9 |
0.842 |
4 |
3 |
0 |
0.000 |
| 5 |
5 |
|
[ADP]B:1302 |
25 |
1 |
553 |
f |
B |
x,y,z |
1_555 |
46 |
17 |
18380 |
312.1 |
-6.7 |
0.370 |
9 |
0 |
0 |
0.499 |
6 |
|
[ADP]A:1302 |
24 |
1 |
550 |
f |
A |
x,y,z |
1_555 |
42 |
16 |
18228 |
302.6 |
-6.1 |
0.452 |
10 |
0 |
0 |
0.499 |
| Average: |
307.4 |
-6.4 |
0.411 |
10 |
0 |
0 |
0.499 |
| 6 |
7 |
|
A |
26 |
7 |
18228 |
x |
A |
-x+3,y-1/2,-z |
2_845 |
26 |
6 |
18228 |
230.4 |
-0.7 |
0.504 |
3 |
1 |
0 |
0.000 |
| 7 |
8 |
|
A |
30 |
11 |
18228 |
◊ |
B |
-x+3,y-1/2,-z |
2_845 |
30 |
10 |
18380 |
222.8 |
1.9 |
0.739 |
2 |
5 |
0 |
0.000 |
| 8 |
9 |
|
B |
15 |
4 |
18380 |
x |
B |
-x+2,y-1/2,-z-1 |
2_744 |
21 |
5 |
18380 |
150.4 |
0.4 |
0.465 |
0 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[IMD]A:1303 |
5 |
1 |
196 |
f |
A |
x,y,z |
1_555 |
29 |
11 |
18228 |
131.2 |
4.2 |
0.404 |
2 |
0 |
0 |
0.000 |
| 10 |
11 |
|
[IMD]B:1303 |
5 |
1 |
196 |
◊ |
B |
x,y,z |
1_555 |
25 |
10 |
18380 |
127.7 |
4.6 |
0.539 |
1 |
0 |
0 |
0.000 |
| 11 |
12 |
|
[IMD]A:1304 |
5 |
1 |
196 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
18228 |
110.9 |
4.8 |
0.542 |
0 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[EDO]A:1306 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
20 |
8 |
18228 |
107.2 |
3.1 |
0.479 |
2 |
0 |
0 |
0.000 |
| 13 |
14 |
|
A |
18 |
7 |
18228 |
x |
A |
x-1,y,z |
1_455 |
12 |
4 |
18228 |
91.8 |
0.4 |
0.535 |
0 |
0 |
0 |
0.000 |
| 14 |
15 |
|
B |
10 |
3 |
18380 |
◊ |
A |
-x+2,y-1/2,-z |
2_745 |
13 |
6 |
18228 |
84.9 |
1.4 |
0.783 |
1 |
0 |
0 |
0.000 |
| 15 |
16 |
|
[IMD]A:1305 |
5 |
1 |
195 |
f |
A |
x,y,z |
1_555 |
12 |
4 |
18228 |
84.4 |
2.6 |
0.206 |
0 |
0 |
0 |
0.000 |
| 16 |
17 |
|
A |
13 |
4 |
18228 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
12 |
5 |
18380 |
83.6 |
-0.0 |
0.583 |
0 |
0 |
0 |
0.000 |
| 17 |
18 |
|
A |
12 |
5 |
18228 |
x |
A |
-x+2,y-1/2,-z |
2_745 |
11 |
4 |
18228 |
71.5 |
-0.1 |
0.487 |
0 |
0 |
0 |
0.000 |
| 18 |
19 |
|
[EDO]B:1304 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
18380 |
71.0 |
2.1 |
0.247 |
0 |
0 |
0 |
0.000 |
| 19 |
20 |
|
B |
13 |
5 |
18380 |
◊ |
A |
x,y,z-1 |
1_554 |
9 |
3 |
18228 |
69.5 |
0.2 |
0.567 |
0 |
1 |
0 |
0.000 |
| 20 |
21 |
|
[EDO]B:1305 |
3 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
14 |
4 |
18380 |
69.1 |
1.6 |
0.237 |
1 |
0 |
0 |
0.000 |
| 21 |
22 |
|
[EDO]B:1305 |
4 |
1 |
184 |
f |
B |
x-1,y,z |
1_455 |
11 |
3 |
18380 |
59.6 |
1.4 |
0.704 |
2 |
0 |
0 |
0.000 |
| 22 |
23 |
|
[MG]A:1301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
18228 |
48.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.267 |
24 |
|
[MG]B:1301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
18380 |
45.7 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.267 |
| Average: |
47.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.267 |
| 23 |
25 |
|
B |
3 |
1 |
18380 |
◊ |
[EDO]B:1305 |
-x+2,y-1/2,-z-1 |
2_744 |
4 |
1 |
184 |
37.6 |
1.8 |
0.972 |
2 |
0 |
0 |
0.000 |
| 24 |
26 |
|
[ADP]A:1302 |
4 |
1 |
550 |
f |
[MG]A:1301 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.5 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.233 |
27 |
|
[ADP]B:1302 |
4 |
1 |
553 |
f |
[MG]B:1301 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.2 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.233 |
| Average: |
31.3 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.233 |
| 25 |
28 |
|
[EDO]B:1304 |
3 |
1 |
184 |
f |
A |
-x+3,y-1/2,-z |
2_845 |
4 |
1 |
18228 |
20.4 |
0.4 |
0.764 |
0 |
0 |
0 |
0.000 |
| 26 |
29 |
|
[IMD]B:1303 |
1 |
1 |
196 |
f |
A |
-x+3,y-1/2,-z |
2_845 |
1 |
1 |
18228 |
3.1 |
0.2 |
0.393 |
0 |
0 |
0 |
0.000 |
|