| ## |
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 |
256 |
58 |
12056 |
◊ |
A |
x,y,z |
1_555 |
273 |
69 |
11422 |
2446.5 |
-21.5 |
0.169 |
36 |
9 |
0 |
0.919 |
2 |
|
F |
256 |
59 |
12077 |
◊ |
E |
x,y,z |
1_555 |
274 |
69 |
11441 |
2419.3 |
-24.8 |
0.095 |
36 |
8 |
0 |
0.919 |
| Average: |
2432.9 |
-23.1 |
0.132 |
36 |
9 |
0 |
0.919 |
| 2 |
3 |
|
H |
100 |
28 |
12289 |
◊ |
A |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
100 |
24 |
11422 |
927.2 |
-5.2 |
0.472 |
10 |
5 |
0 |
0.138 |
4 |
|
D |
104 |
28 |
12392 |
◊ |
E |
x-1/2,-y-1/2,-z+1/2 |
8_445 |
97 |
24 |
11441 |
925.0 |
-6.4 |
0.352 |
11 |
4 |
0 |
0.138 |
| Average: |
926.1 |
-5.8 |
0.412 |
11 |
5 |
0 |
0.138 |
| 3 |
5 |
|
H |
99 |
27 |
12289 |
◊ |
D |
x,y,z |
1_555 |
84 |
18 |
12392 |
822.9 |
-7.0 |
0.248 |
4 |
1 |
0 |
0.000 |
| 4 |
6 |
|
D |
80 |
22 |
12392 |
◊ |
A |
x,y,z |
1_555 |
61 |
21 |
11422 |
711.7 |
-4.9 |
0.333 |
8 |
4 |
0 |
0.400 |
7 |
|
H |
79 |
22 |
12289 |
◊ |
E |
x,y,z |
1_555 |
69 |
21 |
11441 |
698.5 |
-5.8 |
0.295 |
11 |
4 |
0 |
0.400 |
| Average: |
705.1 |
-5.4 |
0.314 |
10 |
4 |
0 |
0.400 |
| 5 |
8 |
|
G |
60 |
13 |
1933 |
◊ |
F |
x,y,z |
1_555 |
84 |
24 |
12077 |
638.8 |
-8.7 |
0.412 |
8 |
0 |
0 |
1.000 |
9 |
|
C |
60 |
13 |
1994 |
◊ |
B |
x,y,z |
1_555 |
82 |
23 |
12056 |
622.0 |
-5.8 |
0.591 |
9 |
0 |
0 |
1.000 |
| Average: |
630.4 |
-7.2 |
0.502 |
9 |
0 |
0 |
1.000 |
| 6 |
10 |
|
C |
62 |
13 |
1994 |
◊ |
A |
x,y,z |
1_555 |
67 |
23 |
11422 |
598.2 |
-6.2 |
0.612 |
13 |
1 |
0 |
0.651 |
11 |
|
G |
58 |
13 |
1933 |
◊ |
E |
x,y,z |
1_555 |
63 |
23 |
11441 |
553.4 |
-6.9 |
0.604 |
11 |
0 |
0 |
0.651 |
| Average: |
575.8 |
-6.6 |
0.608 |
12 |
1 |
0 |
0.651 |
| 7 |
12 |
|
F |
67 |
24 |
12077 |
◊ |
F |
-x+1,y,-z |
3_655 |
66 |
24 |
12077 |
585.9 |
3.4 |
0.855 |
10 |
6 |
0 |
0.000 |
13 |
|
B |
65 |
23 |
12056 |
◊ |
B |
x,-y,-z+1 |
4_556 |
65 |
23 |
12056 |
571.7 |
2.0 |
0.788 |
8 |
2 |
0 |
0.000 |
| Average: |
578.8 |
2.7 |
0.821 |
9 |
4 |
0 |
0.000 |
| 8 |
14 |
|
B |
32 |
13 |
12056 |
◊ |
B |
-x+1,-y,z |
2_655 |
34 |
13 |
12056 |
268.8 |
-1.3 |
0.505 |
2 |
0 |
0 |
0.000 |
| 9 |
15 |
|
C |
31 |
9 |
1994 |
◊ |
D |
x,y,z |
1_555 |
28 |
8 |
12392 |
248.3 |
0.1 |
0.748 |
4 |
0 |
0 |
0.028 |
16 |
|
G |
32 |
7 |
1933 |
◊ |
H |
x,y,z |
1_555 |
27 |
7 |
12289 |
245.8 |
-1.1 |
0.721 |
4 |
0 |
0 |
0.028 |
| Average: |
247.1 |
-0.5 |
0.735 |
4 |
0 |
0 |
0.028 |
| 10 |
17 |
|
D |
21 |
6 |
12392 |
◊ |
F |
x-1/2,-y-1/2,-z+1/2 |
8_445 |
26 |
9 |
12077 |
207.9 |
0.3 |
0.591 |
3 |
3 |
0 |
0.017 |
18 |
|
H |
18 |
5 |
12289 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
24 |
9 |
12056 |
205.8 |
1.4 |
0.721 |
4 |
2 |
0 |
0.017 |
| Average: |
206.8 |
0.9 |
0.656 |
4 |
3 |
0 |
0.017 |
| 11 |
19 |
|
H |
16 |
5 |
12289 |
◊ |
F |
x,y,z |
1_555 |
20 |
7 |
12077 |
164.9 |
-1.2 |
0.407 |
1 |
1 |
0 |
0.024 |
20 |
|
D |
15 |
5 |
12392 |
◊ |
B |
x,y,z |
1_555 |
19 |
6 |
12056 |
145.6 |
-1.5 |
0.315 |
1 |
1 |
0 |
0.024 |
| Average: |
155.3 |
-1.4 |
0.361 |
1 |
1 |
0 |
0.024 |
| 12 |
21 |
|
A |
17 |
3 |
11422 |
◊ |
A |
x,-y,-z+1 |
4_556 |
17 |
3 |
11422 |
164.5 |
-0.1 |
0.664 |
2 |
2 |
0 |
0.000 |
22 |
|
E |
15 |
3 |
11441 |
◊ |
E |
-x+1,y,-z |
3_655 |
15 |
3 |
11441 |
161.3 |
0.3 |
0.706 |
0 |
0 |
0 |
0.000 |
| Average: |
162.9 |
0.1 |
0.685 |
1 |
1 |
0 |
0.000 |
| 13 |
23 |
|
B |
16 |
5 |
12056 |
◊ |
B |
-x+1,y,-z+1 |
3_656 |
16 |
5 |
12056 |
107.0 |
-0.5 |
0.540 |
0 |
0 |
0 |
0.000 |
| 14 |
24 |
|
H |
10 |
4 |
12289 |
◊ |
E |
x-1/2,-y-1/2,-z+1/2 |
8_445 |
10 |
3 |
11441 |
102.6 |
-1.0 |
0.324 |
1 |
1 |
0 |
0.000 |
| 15 |
25 |
|
[PO4]H:214 |
5 |
1 |
187 |
f |
H |
x,y,z |
1_555 |
17 |
8 |
12289 |
90.5 |
-5.1 |
0.630 |
2 |
0 |
0 |
0.214 |
| 16 |
26 |
|
[PO4]D:214 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
13 |
8 |
12392 |
87.8 |
-5.0 |
0.673 |
1 |
0 |
0 |
0.220 |
| 17 |
27 |
|
[PO4]E:204 |
5 |
1 |
186 |
f |
E |
x,y,z |
1_555 |
8 |
4 |
11441 |
61.3 |
-4.3 |
0.471 |
0 |
0 |
0 |
0.236 |
| 18 |
28 |
|
[PO4]C:202 |
5 |
1 |
187 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
1994 |
52.7 |
-2.2 |
0.941 |
2 |
0 |
0 |
0.167 |
| 19 |
29 |
|
[PO4]C:202 |
4 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
11422 |
51.5 |
-3.4 |
0.551 |
0 |
0 |
0 |
0.182 |
| 20 |
30 |
|
[PO4]C:202 |
4 |
1 |
187 |
◊ |
D |
x,y,z |
1_555 |
7 |
4 |
12392 |
49.2 |
-1.6 |
0.907 |
2 |
0 |
0 |
0.101 |
| 21 |
31 |
|
[PO4]E:204 |
4 |
1 |
186 |
◊ |
H |
x,y,z |
1_555 |
6 |
4 |
12289 |
39.9 |
-2.1 |
0.739 |
0 |
0 |
0 |
0.074 |
| 22 |
32 |
|
[PO4]E:204 |
3 |
1 |
186 |
◊ |
G |
x,y,z |
1_555 |
6 |
1 |
1933 |
34.0 |
-1.7 |
0.883 |
1 |
0 |
0 |
0.119 |
| 23 |
33 |
|
[PO4]H:214 |
4 |
1 |
187 |
◊ |
E |
x,y,z |
1_555 |
6 |
4 |
11441 |
32.0 |
-2.0 |
0.535 |
0 |
0 |
0 |
0.071 |
| 24 |
34 |
|
[PO4]D:214 |
3 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
1994 |
28.4 |
-1.1 |
0.866 |
2 |
0 |
0 |
0.021 |
| 25 |
35 |
|
[PO4]D:214 |
4 |
1 |
186 |
◊ |
A |
x,y,z |
1_555 |
4 |
4 |
11422 |
28.4 |
-1.8 |
0.429 |
0 |
0 |
0 |
0.073 |
| 26 |
36 |
|
F |
4 |
2 |
12077 |
◊ |
E |
-x+1,y,-z |
3_655 |
4 |
3 |
11441 |
28.1 |
0.4 |
0.693 |
0 |
0 |
0 |
0.000 |
37 |
|
B |
4 |
2 |
12056 |
◊ |
A |
x,-y,-z+1 |
4_556 |
2 |
2 |
11422 |
21.0 |
1.0 |
0.850 |
0 |
0 |
0 |
0.000 |
| Average: |
24.5 |
0.7 |
0.771 |
0 |
0 |
0 |
0.000 |
| 27 |
38 |
|
[PO4]H:214 |
3 |
1 |
187 |
◊ |
G |
x,y,z |
1_555 |
3 |
2 |
1933 |
27.4 |
-1.1 |
0.864 |
2 |
0 |
0 |
0.019 |
| 28 |
39 |
|
[PO4]H:214 |
3 |
1 |
187 |
◊ |
[PO4]E:204 |
x,y,z |
1_555 |
4 |
1 |
186 |
25.9 |
-2.4 |
0.982 |
0 |
0 |
0 |
0.087 |
| 29 |
40 |
|
[PO4]D:214 |
3 |
1 |
186 |
◊ |
[PO4]C:202 |
x,y,z |
1_555 |
4 |
1 |
187 |
24.7 |
-2.4 |
0.934 |
0 |
0 |
0 |
0.097 |
| 30 |
41 |
|
A |
3 |
2 |
11422 |
◊ |
E |
x-1/2,-y-1/2,-z+1/2 |
8_445 |
3 |
1 |
11441 |
20.7 |
0.7 |
0.850 |
1 |
1 |
0 |
0.000 |
42 |
|
E |
1 |
1 |
11441 |
◊ |
A |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
3 |
1 |
11422 |
2.3 |
0.1 |
0.726 |
0 |
0 |
0 |
0.000 |
| Average: |
11.5 |
0.4 |
0.788 |
1 |
1 |
0 |
0.000 |
| 31 |
43 |
|
F |
1 |
1 |
12077 |
◊ |
B |
-x+1/2,y-1/2,-z+1/2 |
7_545 |
1 |
1 |
12056 |
3.8 |
-0.0 |
0.548 |
0 |
0 |
0 |
0.000 |
|