## |
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 |
|
C |
99 |
7 |
1777 |
◊ |
A |
x,y,z |
1_555 |
125 |
40 |
20793 |
1023.8 |
-16.8 |
0.290 |
20 |
0 |
0 |
0.465 |
2 |
|
D |
100 |
7 |
1810 |
◊ |
B |
x,y,z |
1_555 |
125 |
42 |
20742 |
982.0 |
-13.7 |
0.435 |
18 |
0 |
0 |
0.465 |
Average: |
1002.9 |
-15.3 |
0.362 |
19 |
0 |
0 |
0.465 |
2 |
3 |
|
A |
95 |
26 |
20793 |
x |
A |
-x-1/2,y-1/2,-z |
4_445 |
106 |
34 |
20793 |
955.9 |
-6.1 |
0.147 |
9 |
8 |
0 |
0.000 |
4 |
|
B |
104 |
31 |
20742 |
x |
B |
-x-1/2,y-1/2,-z-1 |
4_444 |
94 |
26 |
20742 |
939.3 |
-5.9 |
0.164 |
9 |
7 |
0 |
0.000 |
Average: |
947.6 |
-6.0 |
0.155 |
9 |
8 |
0 |
0.000 |
3 |
5 |
|
B |
77 |
22 |
20742 |
◊ |
A |
x,y,z-1 |
1_554 |
77 |
23 |
20793 |
731.5 |
11.3 |
0.982 |
14 |
15 |
0 |
0.000 |
4 |
6 |
|
B |
72 |
19 |
20742 |
◊ |
B |
-x-1,y,-z-1 |
2_454 |
72 |
19 |
20742 |
680.9 |
1.1 |
0.666 |
10 |
8 |
0 |
0.000 |
5 |
7 |
|
B |
58 |
16 |
20742 |
◊ |
A |
-x-1,y,-z-1 |
2_454 |
65 |
19 |
20793 |
588.2 |
3.5 |
0.809 |
8 |
1 |
0 |
0.000 |
6 |
8 |
|
B |
49 |
16 |
20742 |
◊ |
A |
x,y,z |
1_555 |
51 |
17 |
20793 |
474.4 |
-1.4 |
0.444 |
0 |
0 |
0 |
0.000 |
7 |
9 |
|
B |
36 |
11 |
20742 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
43 |
12 |
20793 |
349.9 |
-2.4 |
0.213 |
4 |
4 |
0 |
0.000 |
10 |
|
B |
40 |
12 |
20742 |
◊ |
A |
-x-1/2,y-1/2,-z-1 |
4_444 |
33 |
9 |
20793 |
314.2 |
-2.2 |
0.219 |
3 |
3 |
0 |
0.000 |
Average: |
332.1 |
-2.3 |
0.216 |
4 |
4 |
0 |
0.000 |
8 |
11 |
|
[ADP]A:1619 |
25 |
1 |
561 |
f |
A |
x,y,z |
1_555 |
50 |
19 |
20793 |
320.5 |
-4.0 |
0.575 |
13 |
0 |
0 |
0.225 |
12 |
|
[ADP]B:1619 |
22 |
1 |
560 |
f |
B |
x,y,z |
1_555 |
48 |
18 |
20742 |
287.6 |
-5.0 |
0.490 |
16 |
0 |
0 |
0.225 |
Average: |
304.0 |
-4.5 |
0.533 |
15 |
0 |
0 |
0.225 |
9 |
13 |
|
A |
27 |
7 |
20793 |
◊ |
A |
-x-1,y,-z-1 |
2_454 |
27 |
7 |
20793 |
223.4 |
1.8 |
0.755 |
6 |
0 |
0 |
0.000 |
10 |
14 |
|
A |
26 |
11 |
20793 |
◊ |
B |
x-1/2,y+1/2,z |
3_455 |
20 |
7 |
20742 |
199.1 |
1.7 |
0.759 |
4 |
5 |
0 |
0.000 |
11 |
15 |
|
[GOL]A:1622 |
6 |
1 |
220 |
◊ |
A |
-x-1/2,y-1/2,-z |
4_445 |
15 |
7 |
20793 |
93.5 |
-0.5 |
0.420 |
0 |
0 |
0 |
0.000 |
12 |
16 |
|
B |
15 |
7 |
20742 |
◊ |
[GOL]B:1622 |
-x-1/2,y-1/2,-z-1 |
4_444 |
6 |
1 |
220 |
93.0 |
-1.1 |
0.324 |
0 |
0 |
0 |
0.000 |
13 |
17 |
|
[PO4]B:1620 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
20742 |
89.7 |
-5.4 |
0.821 |
4 |
0 |
0 |
0.134 |
14 |
18 |
|
[PO4]A:1620 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
20793 |
89.3 |
-5.3 |
0.823 |
5 |
0 |
0 |
0.135 |
15 |
19 |
|
[GOL]B:1622 |
5 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
20742 |
88.6 |
0.4 |
0.621 |
4 |
0 |
0 |
0.026 |
16 |
20 |
|
[GOL]A:1622 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
20793 |
85.4 |
0.2 |
0.563 |
3 |
0 |
0 |
0.021 |
17 |
21 |
|
[MN]B:1621 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
20742 |
52.0 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.070 |
22 |
|
[MN]A:1621 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
20793 |
52.0 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.070 |
Average: |
52.0 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.070 |
18 |
23 |
|
D |
6 |
2 |
1810 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
20793 |
43.1 |
0.3 |
0.700 |
0 |
0 |
0 |
0.000 |
24 |
|
C |
5 |
2 |
1777 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
20742 |
21.5 |
0.1 |
0.672 |
0 |
0 |
0 |
0.000 |
Average: |
32.3 |
0.2 |
0.686 |
0 |
0 |
0 |
0.000 |
19 |
25 |
|
[MN]A:1621 |
1 |
1 |
123 |
f |
[ADP]A:1619 |
x,y,z |
1_555 |
4 |
1 |
561 |
33.8 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.062 |
26 |
|
[MN]B:1621 |
1 |
1 |
123 |
f |
[ADP]B:1619 |
x,y,z |
1_555 |
4 |
1 |
560 |
33.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.062 |
Average: |
33.7 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.062 |
20 |
27 |
|
A |
5 |
1 |
20793 |
◊ |
C |
-x-1/2,y-1/2,-z |
4_445 |
4 |
1 |
1777 |
32.7 |
0.9 |
0.637 |
0 |
0 |
0 |
0.000 |
28 |
|
D |
4 |
1 |
1810 |
◊ |
B |
-x-1/2,y-1/2,-z-1 |
4_444 |
5 |
1 |
20742 |
32.6 |
0.9 |
0.664 |
0 |
0 |
0 |
0.000 |
Average: |
32.6 |
0.9 |
0.651 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[PO4]B:1620 |
4 |
1 |
187 |
f |
[ADP]B:1619 |
x,y,z |
1_555 |
4 |
1 |
560 |
31.7 |
-2.8 |
0.583 |
0 |
0 |
0 |
0.052 |
22 |
30 |
|
[PO4]A:1620 |
4 |
1 |
188 |
f |
[ADP]A:1619 |
x,y,z |
1_555 |
4 |
1 |
561 |
31.3 |
-2.7 |
0.585 |
0 |
0 |
0 |
0.050 |
23 |
31 |
|
[MN]A:1621 |
1 |
1 |
123 |
f |
[PO4]A:1620 |
x,y,z |
1_555 |
4 |
1 |
188 |
15.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.026 |
24 |
32 |
|
[MN]B:1621 |
1 |
1 |
123 |
f |
[PO4]B:1620 |
x,y,z |
1_555 |
4 |
1 |
187 |
15.2 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.026 |
|