## |
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 |
|
F |
187 |
49 |
8995 |
◊ |
A |
x,y,z |
1_555 |
181 |
39 |
37557 |
1820.9 |
-24.7 |
0.030 |
14 |
5 |
0 |
0.522 |
2 |
2 |
|
G |
172 |
47 |
8648 |
◊ |
B |
x,y,z |
1_555 |
163 |
39 |
37709 |
1651.7 |
-26.4 |
0.015 |
9 |
2 |
0 |
0.514 |
3 |
3 |
|
D |
143 |
38 |
8641 |
◊ |
A |
x,y,z |
1_555 |
112 |
23 |
37557 |
1281.0 |
-16.9 |
0.073 |
14 |
5 |
0 |
0.452 |
4 |
4 |
|
H |
141 |
38 |
8619 |
◊ |
B |
x,y,z |
1_555 |
111 |
22 |
37709 |
1274.8 |
-18.1 |
0.056 |
13 |
5 |
0 |
0.459 |
5 |
5 |
|
B |
108 |
29 |
37709 |
◊ |
A |
x,y,z |
1_555 |
103 |
31 |
37557 |
969.4 |
-9.6 |
0.229 |
4 |
2 |
0 |
0.000 |
6 |
6 |
|
D |
41 |
12 |
8641 |
◊ |
H |
-x+1/2,y-1/2,-z-1 |
3_544 |
50 |
12 |
8619 |
382.6 |
-4.1 |
0.317 |
3 |
1 |
0 |
0.000 |
7 |
7 |
|
D |
47 |
11 |
8641 |
◊ |
H |
-x+1/2,y-1/2,-z-2 |
3_543 |
41 |
14 |
8619 |
382.4 |
-1.9 |
0.553 |
8 |
0 |
0 |
0.000 |
8 |
8 |
|
[ADP]B:901 |
27 |
1 |
559 |
f |
B |
x,y,z |
1_555 |
69 |
26 |
37709 |
369.7 |
-6.4 |
0.570 |
12 |
0 |
0 |
0.220 |
9 |
|
[ADP]A:901 |
27 |
1 |
555 |
f |
A |
x,y,z |
1_555 |
61 |
25 |
37557 |
358.5 |
-6.3 |
0.551 |
12 |
0 |
0 |
0.220 |
Average: |
364.1 |
-6.3 |
0.561 |
12 |
0 |
0 |
0.220 |
9 |
10 |
|
G |
33 |
9 |
8648 |
◊ |
H |
x,y,z |
1_555 |
38 |
10 |
8619 |
356.9 |
-5.5 |
0.192 |
6 |
0 |
0 |
0.089 |
10 |
11 |
|
A |
46 |
14 |
37557 |
◊ |
A |
-x,-y+2,z |
2_575 |
46 |
14 |
37557 |
356.1 |
0.5 |
0.733 |
0 |
2 |
0 |
0.000 |
11 |
12 |
|
F |
36 |
10 |
8995 |
◊ |
D |
x,y,z |
1_555 |
38 |
10 |
8641 |
333.8 |
-6.2 |
0.135 |
4 |
0 |
0 |
0.087 |
12 |
13 |
|
B |
42 |
10 |
37709 |
◊ |
G |
x,y,z-1 |
1_554 |
34 |
9 |
8648 |
285.0 |
-1.5 |
0.578 |
2 |
1 |
0 |
0.000 |
13 |
14 |
|
B |
23 |
6 |
37709 |
◊ |
A |
-x+1,-y+2,z |
2_675 |
36 |
15 |
37557 |
279.4 |
-2.1 |
0.332 |
3 |
1 |
0 |
0.000 |
14 |
15 |
|
A |
34 |
14 |
37557 |
◊ |
A |
-x+1,-y+2,z |
2_675 |
34 |
14 |
37557 |
242.9 |
-0.5 |
0.628 |
0 |
0 |
0 |
0.000 |
15 |
16 |
|
F |
31 |
9 |
8995 |
◊ |
A |
x,y,z-1 |
1_554 |
34 |
10 |
37557 |
240.8 |
-1.2 |
0.541 |
1 |
0 |
0 |
0.000 |
16 |
17 |
|
B |
24 |
9 |
37709 |
◊ |
H |
x,y,z-1 |
1_554 |
33 |
11 |
8619 |
230.3 |
-1.1 |
0.593 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
D |
24 |
9 |
8641 |
◊ |
A |
x,y,z-1 |
1_554 |
31 |
10 |
37557 |
215.3 |
-0.9 |
0.551 |
0 |
0 |
0 |
0.000 |
18 |
19 |
|
B |
14 |
4 |
37709 |
x |
B |
x-1/2,-y+5/2,-z-2 |
4_473 |
11 |
3 |
37709 |
100.1 |
0.1 |
0.676 |
0 |
0 |
0 |
0.000 |
19 |
20 |
|
[VO4]B:902 |
5 |
1 |
197 |
f |
B |
x,y,z |
1_555 |
20 |
12 |
37709 |
90.0 |
-2.7 |
0.693 |
0 |
0 |
0 |
0.050 |
21 |
|
[VO4]A:902 |
5 |
1 |
197 |
f |
A |
x,y,z |
1_555 |
20 |
12 |
37557 |
87.8 |
-2.6 |
0.682 |
0 |
0 |
0 |
0.050 |
Average: |
88.9 |
-2.6 |
0.687 |
0 |
0 |
0 |
0.050 |
20 |
22 |
|
A |
5 |
3 |
37557 |
◊ |
H |
-x+1/2,y-1/2,-z-1 |
3_544 |
10 |
4 |
8619 |
74.3 |
1.7 |
0.853 |
2 |
2 |
0 |
0.000 |
21 |
23 |
|
F |
7 |
3 |
8995 |
◊ |
B |
-x+1,-y+2,z |
2_675 |
5 |
3 |
37709 |
49.7 |
1.1 |
0.812 |
1 |
0 |
0 |
0.000 |
22 |
24 |
|
[VO4]A:902 |
4 |
1 |
197 |
f |
[ADP]A:901 |
x,y,z |
1_555 |
4 |
1 |
555 |
44.4 |
-3.3 |
0.448 |
0 |
0 |
0 |
0.062 |
23 |
25 |
|
[VO4]B:902 |
4 |
1 |
197 |
f |
[ADP]B:901 |
x,y,z |
1_555 |
4 |
1 |
559 |
43.9 |
-3.2 |
0.440 |
0 |
0 |
0 |
0.060 |
24 |
26 |
|
D |
4 |
3 |
8641 |
◊ |
B |
-x+1/2,y-1/2,-z-2 |
3_543 |
3 |
2 |
37709 |
35.7 |
0.7 |
0.648 |
0 |
0 |
0 |
0.000 |
25 |
27 |
|
[MG]A:903 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
37557 |
32.5 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.103 |
28 |
|
[MG]B:903 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
37709 |
32.1 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.103 |
Average: |
32.3 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.103 |
26 |
29 |
|
[MG]A:903 |
1 |
1 |
98 |
f |
[ADP]A:901 |
x,y,z |
1_555 |
4 |
1 |
555 |
28.2 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.080 |
27 |
30 |
|
[MG]B:903 |
1 |
1 |
98 |
f |
[ADP]B:901 |
x,y,z |
1_555 |
3 |
1 |
559 |
27.5 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.073 |
28 |
31 |
|
[MG]A:903 |
1 |
1 |
98 |
f |
[VO4]A:902 |
x,y,z |
1_555 |
2 |
1 |
197 |
19.6 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.039 |
29 |
32 |
|
[MG]B:903 |
1 |
1 |
98 |
f |
[VO4]B:902 |
x,y,z |
1_555 |
3 |
1 |
197 |
16.5 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.036 |
|