| ## |
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 |
249 |
70 |
15631 |
◊ |
A |
x,y,z |
1_555 |
241 |
67 |
15604 |
2375.1 |
-30.3 |
0.077 |
32 |
2 |
0 |
0.315 |
| 2 |
2 |
|
A |
117 |
33 |
15604 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
116 |
33 |
15604 |
1033.3 |
-6.6 |
0.566 |
10 |
2 |
0 |
0.071 |
3 |
|
B |
109 |
31 |
15631 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
111 |
31 |
15631 |
1001.4 |
-4.7 |
0.641 |
14 |
2 |
0 |
0.071 |
| Average: |
1017.4 |
-5.6 |
0.603 |
12 |
2 |
0 |
0.071 |
| 3 |
4 |
|
B |
34 |
14 |
15631 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
32 |
13 |
15604 |
350.1 |
-6.8 |
0.065 |
0 |
0 |
0 |
0.042 |
| 4 |
5 |
|
[OI1]B:406 |
33 |
1 |
684 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
46 |
15 |
15631 |
347.1 |
-0.3 |
0.363 |
1 |
0 |
0 |
0.011 |
6 |
|
[OI1]A:416 |
33 |
1 |
669 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
45 |
15 |
15604 |
344.2 |
-0.6 |
0.317 |
1 |
0 |
0 |
0.011 |
| Average: |
345.7 |
-0.4 |
0.340 |
1 |
0 |
0 |
0.011 |
| 5 |
7 |
|
B |
22 |
8 |
15631 |
x |
B |
x-1/2,-y+3/2,-z+1 |
4_466 |
31 |
10 |
15631 |
254.8 |
0.7 |
0.785 |
4 |
2 |
0 |
0.000 |
| 6 |
8 |
|
[F6P]A:401 |
15 |
1 |
391 |
f |
A |
x,y,z |
1_555 |
36 |
16 |
15604 |
237.4 |
-0.4 |
0.750 |
7 |
0 |
0 |
0.055 |
9 |
|
[F6P]B:411 |
15 |
1 |
385 |
f |
B |
x,y,z |
1_555 |
35 |
17 |
15631 |
234.2 |
-0.9 |
0.706 |
8 |
0 |
0 |
0.055 |
| Average: |
235.8 |
-0.6 |
0.728 |
8 |
0 |
0 |
0.055 |
| 7 |
10 |
|
A |
15 |
5 |
15604 |
x |
A |
x-1/2,-y+3/2,-z |
4_465 |
13 |
6 |
15604 |
150.1 |
-1.4 |
0.436 |
1 |
2 |
0 |
0.000 |
| 8 |
11 |
|
[OI1]B:406 |
12 |
1 |
684 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
15604 |
135.0 |
-2.7 |
0.161 |
0 |
0 |
0 |
0.033 |
12 |
|
[OI1]A:416 |
12 |
1 |
669 |
f |
B |
x,y,z |
1_555 |
17 |
6 |
15631 |
132.0 |
-1.9 |
0.241 |
0 |
0 |
0 |
0.033 |
| Average: |
133.5 |
-2.3 |
0.201 |
0 |
0 |
0 |
0.033 |
| 9 |
13 |
|
[PO4]B:412 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
18 |
11 |
15631 |
115.9 |
-8.0 |
0.713 |
7 |
0 |
0 |
0.078 |
| 10 |
14 |
|
[PO4]A:402 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
11 |
15604 |
106.0 |
-7.3 |
0.690 |
7 |
0 |
0 |
0.073 |
| 11 |
15 |
|
A |
10 |
3 |
15604 |
◊ |
A |
-x+2,-y+1,z |
2_765 |
10 |
3 |
15604 |
99.1 |
-0.0 |
0.677 |
2 |
0 |
0 |
0.000 |
| 12 |
16 |
|
[PO4]B:413 |
5 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
15631 |
86.8 |
-5.0 |
0.758 |
3 |
0 |
0 |
0.044 |
| 13 |
17 |
|
[PO4]A:403 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
15604 |
84.1 |
-5.0 |
0.750 |
2 |
0 |
0 |
0.041 |
| 14 |
18 |
|
[OI1]B:406 |
7 |
1 |
684 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
15631 |
78.4 |
-2.2 |
0.164 |
1 |
0 |
0 |
0.036 |
19 |
|
[OI1]A:416 |
7 |
1 |
669 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
15604 |
76.8 |
-2.0 |
0.154 |
1 |
0 |
0 |
0.036 |
| Average: |
77.6 |
-2.1 |
0.159 |
1 |
0 |
0 |
0.036 |
| 15 |
20 |
|
B |
8 |
2 |
15631 |
◊ |
B |
-x,-y+1,z |
2_565 |
8 |
2 |
15631 |
62.1 |
0.7 |
0.794 |
0 |
0 |
0 |
0.000 |
| 16 |
21 |
|
[MG]B:415 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
15631 |
43.0 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.097 |
22 |
|
[MG]A:405 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
4 |
4 |
15604 |
38.4 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.097 |
| Average: |
40.7 |
-6.9 |
0.000 |
0 |
0 |
0 |
0.097 |
| 17 |
23 |
|
[F6P]B:411 |
4 |
1 |
385 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
15604 |
41.3 |
-0.2 |
0.563 |
2 |
0 |
0 |
0.016 |
24 |
|
[F6P]A:401 |
4 |
1 |
391 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
15631 |
39.4 |
-0.3 |
0.572 |
2 |
0 |
0 |
0.016 |
| Average: |
40.4 |
-0.2 |
0.568 |
2 |
0 |
0 |
0.016 |
| 18 |
25 |
|
[OI1]B:406 |
6 |
1 |
684 |
◊ |
[OI1]A:416 |
-x+1,-y+1,z |
2_665 |
6 |
1 |
669 |
38.5 |
2.0 |
0.675 |
0 |
0 |
0 |
0.000 |
| 19 |
26 |
|
A |
4 |
2 |
15604 |
◊ |
B |
x,y,z-1 |
1_554 |
4 |
2 |
15631 |
37.4 |
-0.4 |
0.473 |
0 |
0 |
0 |
0.000 |
| 20 |
27 |
|
[PO4]A:403 |
4 |
1 |
187 |
f |
[F6P]A:401 |
x,y,z |
1_555 |
4 |
1 |
391 |
36.0 |
-0.9 |
0.846 |
0 |
0 |
0 |
0.006 |
| 21 |
28 |
|
[PO4]B:413 |
4 |
1 |
187 |
f |
[F6P]B:411 |
x,y,z |
1_555 |
4 |
1 |
385 |
35.0 |
-0.8 |
0.856 |
0 |
0 |
0 |
0.005 |
| 22 |
29 |
|
[MG]B:414 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
15631 |
30.7 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.076 |
30 |
|
[MG]A:404 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
7 |
5 |
15604 |
30.5 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.076 |
| Average: |
30.6 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.076 |
| 23 |
31 |
|
B |
5 |
2 |
15631 |
◊ |
A |
x-1,y,z |
1_455 |
3 |
1 |
15604 |
28.1 |
0.3 |
0.648 |
1 |
0 |
0 |
0.000 |
| 24 |
32 |
|
[PO4]B:413 |
4 |
1 |
187 |
f |
[MG]B:414 |
x,y,z |
1_555 |
1 |
1 |
98 |
23.5 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.049 |
33 |
|
[PO4]A:403 |
3 |
1 |
187 |
f |
[MG]A:405 |
x,y,z |
1_555 |
1 |
1 |
98 |
22.9 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.049 |
| Average: |
23.2 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.049 |
| 25 |
34 |
|
[PO4]A:403 |
4 |
1 |
187 |
f |
[MG]A:404 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.8 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.046 |
35 |
|
[PO4]B:413 |
1 |
1 |
187 |
f |
[MG]B:415 |
x,y,z |
1_555 |
1 |
1 |
98 |
21.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.046 |
| Average: |
21.7 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.046 |
| 26 |
36 |
|
[MG]B:414 |
1 |
1 |
98 |
f |
[F6P]B:411 |
x,y,z |
1_555 |
3 |
1 |
385 |
17.7 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.014 |
37 |
|
[MG]A:404 |
1 |
1 |
98 |
f |
[F6P]A:401 |
x,y,z |
1_555 |
4 |
1 |
391 |
16.9 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.014 |
| Average: |
17.3 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.014 |
| 27 |
38 |
|
[MG]A:405 |
1 |
1 |
98 |
f |
[MG]A:404 |
x,y,z |
1_555 |
1 |
1 |
98 |
6.4 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.009 |
| 28 |
39 |
|
[OI1]B:406 |
1 |
1 |
684 |
◊ |
A |
-x+1,-y+1,z |
2_665 |
1 |
1 |
15604 |
6.1 |
0.1 |
0.438 |
0 |
0 |
0 |
0.000 |
40 |
|
[OI1]A:416 |
1 |
1 |
669 |
◊ |
B |
-x+1,-y+1,z |
2_665 |
1 |
1 |
15631 |
3.6 |
0.1 |
0.456 |
0 |
0 |
0 |
0.000 |
| Average: |
4.9 |
0.1 |
0.447 |
0 |
0 |
0 |
0.000 |
| 29 |
41 |
|
[MG]B:415 |
1 |
1 |
98 |
f |
[MG]B:414 |
x,y,z |
1_555 |
1 |
1 |
98 |
3.0 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.004 |
|