| ## |
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 |
|
D |
135 |
34 |
18558 |
◊ |
A |
x,y,z |
1_555 |
143 |
34 |
18479 |
1273.1 |
-7.8 |
0.271 |
12 |
11 |
0 |
0.254 |
2 |
|
C |
138 |
34 |
18456 |
◊ |
B |
x,y,z |
1_555 |
142 |
37 |
18353 |
1254.0 |
-8.4 |
0.242 |
14 |
9 |
0 |
0.254 |
| Average: |
1263.5 |
-8.1 |
0.256 |
13 |
10 |
0 |
0.254 |
| 2 |
3 |
|
C |
120 |
32 |
18456 |
◊ |
A |
x,y,z |
1_555 |
118 |
31 |
18479 |
1106.7 |
-2.3 |
0.552 |
16 |
18 |
0 |
0.186 |
4 |
|
D |
115 |
31 |
18558 |
◊ |
B |
x,y,z |
1_555 |
116 |
32 |
18353 |
1087.5 |
-1.4 |
0.613 |
19 |
18 |
0 |
0.186 |
| Average: |
1097.1 |
-1.8 |
0.582 |
18 |
18 |
0 |
0.186 |
| 3 |
5 |
|
A |
51 |
15 |
18479 |
◊ |
C |
x-1,y,z |
1_455 |
50 |
15 |
18456 |
461.0 |
0.5 |
0.670 |
6 |
8 |
0 |
0.000 |
| 4 |
6 |
|
D |
38 |
12 |
18558 |
◊ |
C |
-x-1,y-1/2,-z-1 |
2_444 |
32 |
8 |
18456 |
313.0 |
1.4 |
0.659 |
6 |
0 |
0 |
0.000 |
| 5 |
7 |
|
D |
25 |
8 |
18558 |
◊ |
B |
x-1,y,z |
1_455 |
28 |
9 |
18353 |
243.6 |
-2.5 |
0.289 |
3 |
0 |
0 |
0.000 |
| 6 |
8 |
|
D |
23 |
8 |
18558 |
◊ |
A |
-x-2,y-1/2,-z-2 |
2_343 |
25 |
8 |
18479 |
224.8 |
-3.5 |
0.145 |
0 |
0 |
0 |
0.000 |
| 7 |
9 |
|
A |
21 |
5 |
18479 |
◊ |
B |
x,y,z-1 |
1_554 |
29 |
7 |
18353 |
218.5 |
-1.7 |
0.349 |
4 |
1 |
0 |
0.000 |
| 8 |
10 |
|
A |
24 |
8 |
18479 |
x |
A |
x-1,y,z |
1_455 |
26 |
9 |
18479 |
201.6 |
-2.8 |
0.226 |
0 |
0 |
0 |
0.000 |
11 |
|
C |
22 |
8 |
18456 |
x |
C |
x-1,y,z |
1_455 |
23 |
7 |
18456 |
189.9 |
-2.8 |
0.208 |
0 |
0 |
0 |
0.000 |
| Average: |
195.7 |
-2.8 |
0.217 |
0 |
0 |
0 |
0.000 |
| 9 |
12 |
|
D |
25 |
9 |
18558 |
◊ |
A |
-x-1,y-1/2,-z-2 |
2_443 |
15 |
4 |
18479 |
193.1 |
-2.1 |
0.204 |
1 |
0 |
0 |
0.000 |
| 10 |
13 |
|
D |
26 |
9 |
18558 |
◊ |
B |
x,y,z-1 |
1_554 |
19 |
5 |
18353 |
184.6 |
-1.4 |
0.373 |
0 |
0 |
0 |
0.000 |
| 11 |
14 |
|
[GOL]B:702 |
6 |
1 |
215 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
18353 |
134.8 |
-0.2 |
0.601 |
3 |
0 |
0 |
0.022 |
| 12 |
15 |
|
[GOL]C:701 |
6 |
1 |
218 |
f |
C |
x,y,z |
1_555 |
22 |
10 |
18456 |
129.6 |
1.8 |
0.708 |
3 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[PO4]A:604 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
22 |
12 |
18479 |
122.0 |
-7.8 |
0.699 |
6 |
0 |
0 |
0.180 |
| 14 |
17 |
|
B |
14 |
3 |
18353 |
◊ |
C |
-x-1,y-1/2,-z-1 |
2_444 |
15 |
6 |
18456 |
120.7 |
-1.1 |
0.390 |
1 |
0 |
0 |
0.000 |
| 15 |
18 |
|
[PO4]C:605 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
21 |
11 |
18456 |
119.7 |
-8.2 |
0.630 |
6 |
0 |
0 |
0.143 |
| 16 |
19 |
|
[PO4]B:603 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
22 |
11 |
18353 |
119.6 |
-7.7 |
0.699 |
6 |
0 |
0 |
0.154 |
| 17 |
20 |
|
[PO4]D:601 |
5 |
1 |
188 |
f |
D |
x,y,z |
1_555 |
23 |
12 |
18558 |
119.1 |
-8.1 |
0.653 |
6 |
0 |
0 |
0.186 |
| 18 |
21 |
|
D |
14 |
5 |
18558 |
x |
D |
x-1,y,z |
1_455 |
12 |
5 |
18558 |
110.8 |
-1.2 |
0.366 |
0 |
0 |
0 |
0.000 |
22 |
|
B |
14 |
5 |
18353 |
x |
B |
x-1,y,z |
1_455 |
13 |
4 |
18353 |
96.0 |
-0.8 |
0.439 |
0 |
0 |
0 |
0.000 |
| Average: |
103.4 |
-1.0 |
0.403 |
0 |
0 |
0 |
0.000 |
| 19 |
23 |
|
[PO4]B:607 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
18353 |
99.6 |
-7.0 |
0.611 |
3 |
0 |
0 |
0.124 |
| 20 |
24 |
|
B |
10 |
5 |
18353 |
◊ |
C |
-x,y-1/2,-z-1 |
2_544 |
11 |
4 |
18456 |
88.5 |
-0.1 |
0.583 |
0 |
0 |
0 |
0.000 |
| 21 |
25 |
|
[PO4]C:608 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
18456 |
81.8 |
-3.6 |
0.895 |
3 |
0 |
0 |
0.064 |
| 22 |
26 |
|
[PO4]A:610 |
4 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
18479 |
77.5 |
-4.2 |
0.803 |
4 |
0 |
0 |
0.103 |
| 23 |
27 |
|
[PO4]D:602 |
4 |
1 |
189 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
18558 |
76.0 |
-3.2 |
0.853 |
2 |
0 |
0 |
0.071 |
| 24 |
28 |
|
[PO4]D:606 |
5 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
18558 |
73.8 |
-4.5 |
0.700 |
3 |
0 |
0 |
0.100 |
| 25 |
29 |
|
[PO4]C:611 |
4 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
18456 |
72.2 |
-4.5 |
0.776 |
4 |
0 |
0 |
0.082 |
| 26 |
30 |
|
[PO4]B:609 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
18353 |
72.2 |
-4.4 |
0.786 |
5 |
0 |
0 |
0.098 |
| 27 |
31 |
|
[PO4]B:612 |
4 |
1 |
187 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
18353 |
71.1 |
-3.2 |
0.845 |
3 |
0 |
0 |
0.067 |
| 28 |
32 |
|
[PO4]B:609 |
5 |
1 |
189 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
18456 |
69.0 |
-3.0 |
0.893 |
1 |
0 |
0 |
0.046 |
| 29 |
33 |
|
[PO4]D:606 |
5 |
1 |
187 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
18479 |
67.8 |
-2.8 |
0.908 |
2 |
0 |
0 |
0.064 |
| 30 |
34 |
|
[PO4]C:611 |
5 |
1 |
188 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
18353 |
58.1 |
-2.6 |
0.890 |
1 |
0 |
0 |
0.040 |
| 31 |
35 |
|
[PO4]A:610 |
4 |
1 |
188 |
◊ |
D |
x,y,z |
1_555 |
6 |
2 |
18558 |
54.6 |
-2.1 |
0.912 |
1 |
0 |
0 |
0.043 |
| 32 |
36 |
|
[GOL]B:702 |
3 |
1 |
215 |
◊ |
C |
x,y,z |
1_555 |
6 |
1 |
18456 |
37.1 |
-0.4 |
0.561 |
0 |
0 |
0 |
0.005 |
| 33 |
37 |
|
D |
5 |
2 |
18558 |
◊ |
C |
-x,y-1/2,-z-1 |
2_544 |
6 |
2 |
18456 |
36.8 |
0.4 |
0.618 |
0 |
0 |
0 |
0.000 |
| 34 |
38 |
|
[PO4]C:608 |
3 |
1 |
188 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
18479 |
33.5 |
-1.1 |
0.918 |
1 |
0 |
0 |
0.009 |
| 35 |
39 |
|
[PO4]D:602 |
4 |
1 |
189 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
18353 |
32.4 |
-0.9 |
0.937 |
1 |
0 |
0 |
0.020 |
| 36 |
40 |
|
[PO4]B:612 |
3 |
1 |
187 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
18558 |
30.9 |
-0.9 |
0.956 |
1 |
0 |
0 |
0.020 |
| 37 |
41 |
|
A |
3 |
1 |
18479 |
◊ |
C |
x-1,y,z-1 |
1_454 |
6 |
2 |
18456 |
20.8 |
-0.2 |
0.504 |
0 |
0 |
0 |
0.000 |
| 38 |
42 |
|
[PO4]A:610 |
2 |
1 |
188 |
◊ |
C |
x-1,y,z |
1_455 |
4 |
2 |
18456 |
19.9 |
-1.0 |
0.847 |
0 |
0 |
0 |
0.000 |
| 39 |
43 |
|
A |
4 |
2 |
18479 |
◊ |
[PO4]C:611 |
x-1,y,z |
1_455 |
3 |
1 |
188 |
16.2 |
-0.7 |
0.852 |
0 |
0 |
0 |
0.000 |
| 40 |
44 |
|
D |
1 |
1 |
18558 |
◊ |
B |
x-1,y,z-1 |
1_454 |
1 |
1 |
18353 |
0.4 |
0.0 |
0.639 |
0 |
0 |
0 |
0.000 |
|