| ## |
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 |
270 |
80 |
14923 |
◊ |
A |
x,y,z |
1_555 |
274 |
85 |
15505 |
2641.6 |
-22.6 |
0.228 |
43 |
16 |
0 |
0.433 |
| 2 |
2 |
|
A |
79 |
27 |
15505 |
◊ |
A |
-x,y,-z+1 |
5_556 |
78 |
27 |
15505 |
771.3 |
-1.9 |
0.665 |
10 |
2 |
0 |
0.000 |
| 3 |
3 |
|
B |
48 |
16 |
14923 |
◊ |
A |
-y+1,-x+1,-z+5/4 |
8_666 |
41 |
14 |
15505 |
432.3 |
-1.4 |
0.589 |
8 |
0 |
0 |
0.045 |
| 4 |
4 |
|
A |
43 |
14 |
15505 |
◊ |
A |
-y+1,-x+1,-z+5/4 |
8_666 |
41 |
14 |
15505 |
399.3 |
-1.3 |
0.592 |
3 |
0 |
0 |
0.026 |
5 |
|
B |
42 |
14 |
14923 |
◊ |
B |
-y+1,-x+1,-z+5/4 |
8_666 |
43 |
15 |
14923 |
386.2 |
-0.8 |
0.666 |
5 |
0 |
0 |
0.026 |
| Average: |
392.7 |
-1.0 |
0.629 |
4 |
0 |
0 |
0.026 |
| 5 |
6 |
|
A |
32 |
9 |
15505 |
◊ |
B |
-y+1,x,z+1/4 |
3_655 |
28 |
8 |
14923 |
270.5 |
2.0 |
0.860 |
2 |
4 |
0 |
0.000 |
| 6 |
7 |
|
[AMP]A:402 |
22 |
1 |
463 |
◊ |
A |
x,y,z |
1_555 |
36 |
14 |
15505 |
238.8 |
1.6 |
0.723 |
2 |
0 |
0 |
0.000 |
| 7 |
8 |
|
B |
16 |
5 |
14923 |
◊ |
B |
x,-y+1,-z+1/2 |
6_565 |
16 |
5 |
14923 |
151.3 |
-0.9 |
0.527 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
[3PO]B:404 |
13 |
1 |
316 |
f |
B |
x,y,z |
1_555 |
21 |
9 |
14923 |
137.1 |
-3.0 |
0.812 |
10 |
0 |
0 |
0.073 |
| 9 |
10 |
|
[3PO]B:404 |
12 |
1 |
316 |
◊ |
A |
x,y,z |
1_555 |
19 |
10 |
15505 |
108.5 |
-1.4 |
0.866 |
3 |
0 |
0 |
0.027 |
| 10 |
11 |
|
[AMP]A:402 |
14 |
1 |
463 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
14923 |
91.1 |
-0.4 |
0.486 |
0 |
0 |
0 |
0.004 |
| 11 |
12 |
|
[POP]A:404 |
9 |
1 |
260 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
15505 |
81.8 |
0.6 |
0.600 |
3 |
0 |
0 |
0.008 |
| 12 |
13 |
|
[POP]A:404 |
8 |
1 |
260 |
◊ |
B |
x,y,z |
1_555 |
10 |
6 |
14923 |
68.1 |
0.7 |
0.752 |
1 |
0 |
0 |
0.000 |
| 13 |
14 |
|
[PO4]A:405 |
5 |
1 |
188 |
◊ |
A |
x,y,z |
1_555 |
10 |
3 |
15505 |
51.5 |
-1.7 |
0.955 |
3 |
0 |
0 |
0.030 |
| 14 |
15 |
|
[PO4]A:405 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
14923 |
50.3 |
-2.6 |
0.836 |
2 |
0 |
0 |
0.034 |
| 15 |
16 |
|
[POP]A:404 |
6 |
1 |
260 |
◊ |
[AMP]A:402 |
x,y,z |
1_555 |
7 |
1 |
463 |
38.0 |
0.3 |
0.500 |
0 |
0 |
0 |
0.000 |
| 16 |
17 |
|
[MG]B:401 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
14923 |
37.5 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.081 |
18 |
|
[MG]A:403 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
15505 |
31.4 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.081 |
| Average: |
34.5 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.081 |
| 17 |
19 |
|
[PO4]A:405 |
4 |
1 |
188 |
◊ |
[POP]A:404 |
x,y,z |
1_555 |
5 |
1 |
260 |
35.1 |
-1.6 |
0.741 |
0 |
0 |
0 |
0.016 |
| 18 |
20 |
|
[MG]A:401 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
10 |
6 |
15505 |
34.4 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.058 |
21 |
|
[MG]B:403 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
8 |
5 |
14923 |
30.9 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.058 |
| Average: |
32.6 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.058 |
| 19 |
22 |
|
[3PO]B:404 |
3 |
1 |
316 |
f |
[MG]B:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
30.3 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.048 |
| 20 |
23 |
|
[MG]A:401 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
14923 |
29.6 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.028 |
24 |
|
[MG]B:403 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
2 |
2 |
15505 |
10.2 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.028 |
| Average: |
19.9 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.028 |
| 21 |
25 |
|
[3PO]B:404 |
5 |
1 |
316 |
f |
[MG]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
28.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.040 |
| 22 |
26 |
|
[POP]A:404 |
4 |
1 |
260 |
f |
[MG]A:403 |
x,y,z |
1_555 |
1 |
1 |
98 |
26.0 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.029 |
| 23 |
27 |
|
[POP]A:404 |
5 |
1 |
260 |
f |
[MG]B:403 |
x,y,z |
1_555 |
1 |
1 |
98 |
25.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.033 |
| 24 |
28 |
|
[PO4]A:405 |
3 |
1 |
188 |
◊ |
[MG]A:403 |
x,y,z |
1_555 |
1 |
1 |
98 |
19.3 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.029 |
| 25 |
29 |
|
[PO4]A:405 |
4 |
1 |
188 |
◊ |
[MG]B:403 |
x,y,z |
1_555 |
1 |
1 |
98 |
19.1 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.028 |
| 26 |
30 |
|
[MG]B:401 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
15505 |
5.8 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.004 |
31 |
|
[MG]A:403 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
14923 |
2.1 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.004 |
| Average: |
4.0 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.004 |
| 27 |
32 |
|
[MG]B:403 |
1 |
1 |
98 |
f |
[MG]A:403 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.6 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.009 |
| 28 |
33 |
|
[MG]B:401 |
1 |
1 |
98 |
f |
[MG]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
0.3 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|