| ## |
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 |
95 |
29 |
12347 |
◊ |
A |
x,y,z |
1_555 |
124 |
34 |
12599 |
1065.3 |
-6.8 |
0.382 |
13 |
13 |
0 |
0.506 |
2 |
|
C |
98 |
28 |
12718 |
◊ |
B |
x,y,z |
1_555 |
118 |
30 |
12347 |
1063.5 |
-6.7 |
0.369 |
12 |
11 |
0 |
0.506 |
3 |
|
F |
109 |
29 |
12203 |
◊ |
D |
x,y,z |
1_555 |
102 |
28 |
12068 |
1020.8 |
-6.8 |
0.311 |
10 |
11 |
0 |
0.506 |
4 |
|
E |
84 |
25 |
12349 |
◊ |
D |
x,y,z |
1_555 |
100 |
27 |
12068 |
987.3 |
-7.9 |
0.262 |
12 |
10 |
0 |
0.506 |
5 |
|
C |
111 |
28 |
12718 |
◊ |
A |
x,y,z |
1_555 |
85 |
24 |
12599 |
986.6 |
-8.1 |
0.231 |
11 |
9 |
0 |
0.506 |
6 |
|
F |
93 |
25 |
12203 |
◊ |
E |
x,y,z |
1_555 |
103 |
29 |
12349 |
973.3 |
-6.3 |
0.353 |
13 |
11 |
0 |
0.506 |
| Average: |
1016.1 |
-7.1 |
0.318 |
12 |
11 |
0 |
0.506 |
| 2 |
7 |
|
A |
55 |
17 |
12599 |
◊ |
E |
x,y,z-1 |
1_554 |
50 |
16 |
12349 |
547.3 |
-4.9 |
0.278 |
6 |
2 |
0 |
0.000 |
8 |
|
C |
44 |
14 |
12718 |
◊ |
F |
x-1,y,z-1 |
1_454 |
53 |
17 |
12203 |
470.4 |
-3.0 |
0.416 |
6 |
2 |
0 |
0.000 |
| Average: |
508.9 |
-3.9 |
0.347 |
6 |
2 |
0 |
0.000 |
| 3 |
9 |
|
F |
41 |
13 |
12203 |
◊ |
A |
x,y,z |
1_555 |
45 |
12 |
12599 |
346.7 |
0.5 |
0.748 |
2 |
0 |
0 |
0.000 |
10 |
|
D |
42 |
12 |
12068 |
◊ |
C |
x,y,z |
1_555 |
38 |
11 |
12718 |
310.8 |
-0.3 |
0.650 |
2 |
0 |
0 |
0.000 |
11 |
|
E |
38 |
11 |
12349 |
◊ |
B |
x,y,z |
1_555 |
39 |
11 |
12347 |
294.4 |
0.3 |
0.713 |
2 |
0 |
0 |
0.000 |
| Average: |
317.3 |
0.2 |
0.704 |
2 |
0 |
0 |
0.000 |
| 4 |
12 |
|
A |
28 |
9 |
12599 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
37 |
14 |
12068 |
324.0 |
3.0 |
0.901 |
11 |
6 |
0 |
0.000 |
| 5 |
13 |
|
B |
33 |
10 |
12347 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
32 |
11 |
12068 |
250.0 |
0.1 |
0.687 |
3 |
1 |
0 |
0.000 |
| 6 |
14 |
|
E |
22 |
8 |
12349 |
◊ |
F |
-x,y-1/2,-z |
2_545 |
23 |
8 |
12203 |
202.5 |
-1.1 |
0.474 |
2 |
0 |
0 |
0.000 |
| 7 |
15 |
|
B |
22 |
7 |
12347 |
◊ |
C |
-x-1,y-1/2,-z-1 |
2_444 |
29 |
10 |
12718 |
184.2 |
2.5 |
0.861 |
1 |
0 |
0 |
0.000 |
| 8 |
16 |
|
B |
18 |
7 |
12347 |
◊ |
A |
x-1,y,z |
1_455 |
25 |
7 |
12599 |
183.1 |
-1.0 |
0.431 |
4 |
0 |
0 |
0.000 |
| 9 |
17 |
|
[8H8]A:405 |
10 |
1 |
288 |
f |
A |
x,y,z |
1_555 |
28 |
11 |
12599 |
158.1 |
-1.9 |
0.461 |
0 |
0 |
0 |
0.018 |
| 10 |
18 |
|
[8H8]A:406 |
10 |
1 |
293 |
f |
B |
x,y,z |
1_555 |
26 |
14 |
12347 |
157.4 |
-2.2 |
0.384 |
0 |
0 |
0 |
0.100 |
| 11 |
19 |
|
[8H8]D:502 |
10 |
1 |
288 |
f |
D |
x,y,z |
1_555 |
25 |
9 |
12068 |
147.1 |
-0.9 |
0.512 |
0 |
0 |
0 |
0.011 |
| 12 |
20 |
|
[8H8]E:603 |
10 |
1 |
284 |
f |
F |
x,y,z |
1_555 |
22 |
9 |
12203 |
141.5 |
-1.6 |
0.409 |
1 |
0 |
0 |
0.100 |
| 13 |
21 |
|
[PO4]C:402 |
5 |
1 |
189 |
f |
C |
x,y,z |
1_555 |
18 |
10 |
12718 |
119.9 |
-8.1 |
0.701 |
5 |
0 |
0 |
0.099 |
| 14 |
22 |
|
[PO4]A:401 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
12599 |
111.8 |
-7.8 |
0.760 |
9 |
0 |
0 |
0.114 |
| 15 |
23 |
|
[8H8]D:502 |
10 |
1 |
288 |
◊ |
F |
x,y,z |
1_555 |
17 |
4 |
12203 |
104.5 |
-0.5 |
0.599 |
0 |
0 |
0 |
0.006 |
| 16 |
24 |
|
[8H8]E:603 |
10 |
1 |
284 |
◊ |
E |
x,y,z |
1_555 |
17 |
4 |
12349 |
98.4 |
-0.0 |
0.666 |
0 |
0 |
0 |
0.000 |
| 17 |
25 |
|
[PO4]A:404 |
5 |
1 |
190 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
12599 |
98.1 |
-7.0 |
0.642 |
3 |
0 |
0 |
0.081 |
| 18 |
26 |
|
[PO4]E:601 |
5 |
1 |
188 |
f |
E |
x,y,z |
1_555 |
15 |
9 |
12349 |
97.7 |
-6.5 |
0.688 |
5 |
0 |
0 |
0.107 |
| 19 |
27 |
|
[8H8]A:405 |
10 |
1 |
288 |
◊ |
C |
x,y,z |
1_555 |
13 |
3 |
12718 |
87.1 |
-1.2 |
0.490 |
0 |
0 |
0 |
0.012 |
| 20 |
28 |
|
[8H8]A:406 |
7 |
1 |
293 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
12599 |
85.8 |
0.2 |
0.689 |
0 |
0 |
0 |
0.000 |
| 21 |
29 |
|
[PO4]C:401 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
12718 |
84.2 |
-5.9 |
0.563 |
3 |
0 |
0 |
0.069 |
| 22 |
30 |
|
[PO4]A:403 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
12599 |
82.7 |
-5.7 |
0.602 |
4 |
0 |
0 |
0.072 |
| 23 |
31 |
|
[PO4]D:501 |
5 |
1 |
188 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
12068 |
82.6 |
-5.8 |
0.591 |
3 |
0 |
0 |
0.089 |
| 24 |
32 |
|
[PO4]E:602 |
5 |
1 |
188 |
f |
E |
x,y,z |
1_555 |
13 |
6 |
12349 |
82.4 |
-5.6 |
0.610 |
3 |
0 |
0 |
0.085 |
| 25 |
33 |
|
E |
12 |
5 |
12349 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
10 |
3 |
12068 |
78.5 |
0.0 |
0.641 |
0 |
0 |
0 |
0.000 |
| 26 |
34 |
|
E |
9 |
3 |
12349 |
◊ |
C |
-x-1,y-1/2,-z-1 |
2_444 |
9 |
3 |
12718 |
74.3 |
0.7 |
0.707 |
1 |
2 |
0 |
0.000 |
| 27 |
35 |
|
[PO4]F:501 |
5 |
1 |
190 |
f |
E |
x,y,z |
1_555 |
8 |
4 |
12349 |
68.4 |
-3.8 |
0.818 |
3 |
0 |
0 |
0.062 |
| 28 |
36 |
|
[PO4]F:501 |
4 |
1 |
190 |
◊ |
F |
x,y,z |
1_555 |
9 |
3 |
12203 |
60.5 |
-2.9 |
0.824 |
3 |
0 |
0 |
0.052 |
| 29 |
37 |
|
[PO4]A:402 |
4 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
12599 |
59.9 |
-2.7 |
0.908 |
2 |
0 |
0 |
0.035 |
| 30 |
38 |
|
[PO4]A:402 |
4 |
1 |
188 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
12718 |
57.0 |
-2.7 |
0.890 |
1 |
0 |
0 |
0.031 |
| 31 |
39 |
|
[PO4]A:402 |
4 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
12347 |
54.0 |
-2.5 |
0.902 |
1 |
0 |
0 |
0.028 |
| 32 |
40 |
|
[PO4]F:501 |
4 |
1 |
190 |
f |
[PO4]E:601 |
x,y,z |
1_555 |
4 |
1 |
188 |
36.3 |
-3.4 |
0.973 |
0 |
0 |
0 |
0.041 |
| 33 |
41 |
|
[PO4]A:404 |
4 |
1 |
190 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
12347 |
29.5 |
-1.0 |
0.906 |
0 |
0 |
0 |
0.009 |
| 34 |
42 |
|
[PO4]A:404 |
3 |
1 |
190 |
◊ |
D |
-x-1,y-1/2,-z-1 |
2_444 |
1 |
1 |
12068 |
25.2 |
-0.2 |
0.989 |
1 |
0 |
0 |
0.000 |
| 35 |
43 |
|
C |
2 |
1 |
12718 |
◊ |
[PO4]D:501 |
x,y,z-1 |
1_554 |
3 |
1 |
188 |
24.6 |
-0.1 |
0.981 |
1 |
0 |
0 |
0.000 |
| 36 |
44 |
|
C |
4 |
3 |
12718 |
◊ |
D |
x,y,z-1 |
1_554 |
4 |
3 |
12068 |
20.9 |
-0.4 |
0.404 |
0 |
0 |
0 |
0.000 |
45 |
|
B |
1 |
1 |
12347 |
◊ |
E |
x-1,y,z-1 |
1_454 |
4 |
2 |
12349 |
13.8 |
-0.3 |
0.278 |
0 |
0 |
0 |
0.000 |
| Average: |
17.4 |
-0.4 |
0.341 |
0 |
0 |
0 |
0.000 |
| 37 |
46 |
|
[PO4]E:601 |
3 |
1 |
188 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
12203 |
11.7 |
-0.4 |
0.921 |
0 |
0 |
0 |
0.004 |
| 38 |
47 |
|
[8H8]E:603 |
4 |
1 |
284 |
◊ |
[PO4]F:501 |
x,y,z |
1_555 |
2 |
1 |
190 |
11.6 |
-0.7 |
0.783 |
0 |
0 |
0 |
0.008 |
| 39 |
48 |
|
[PO4]A:401 |
1 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
12347 |
4.1 |
-0.1 |
0.800 |
0 |
0 |
0 |
0.001 |
| 40 |
49 |
|
F |
1 |
1 |
12203 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
12347 |
3.6 |
0.1 |
0.762 |
0 |
0 |
0 |
0.000 |
50 |
|
D |
1 |
1 |
12068 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
12599 |
1.1 |
0.0 |
0.586 |
0 |
0 |
0 |
0.000 |
51 |
|
E |
1 |
1 |
12349 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
12718 |
0.6 |
-0.0 |
0.607 |
0 |
0 |
0 |
0.000 |
| Average: |
1.7 |
0.0 |
0.651 |
0 |
0 |
0 |
0.000 |
| 41 |
52 |
|
[8H8]E:603 |
2 |
1 |
284 |
◊ |
[PO4]E:601 |
x,y,z |
1_555 |
1 |
1 |
188 |
3.4 |
-0.3 |
0.663 |
0 |
0 |
0 |
0.003 |
|