## |
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 |
|
C |
103 |
25 |
19124 |
◊ |
A |
x,y,z |
1_555 |
94 |
26 |
18625 |
848.7 |
-4.3 |
0.365 |
19 |
6 |
0 |
0.402 |
2 |
|
B |
94 |
24 |
18652 |
◊ |
A |
x,y,z |
1_555 |
94 |
27 |
18625 |
818.6 |
-5.1 |
0.267 |
15 |
6 |
0 |
0.402 |
3 |
|
C |
92 |
24 |
19124 |
◊ |
B |
x,y,z |
1_555 |
96 |
27 |
18652 |
800.6 |
-5.3 |
0.279 |
14 |
4 |
0 |
0.402 |
Average: |
822.6 |
-4.9 |
0.303 |
16 |
5 |
0 |
0.402 |
2 |
4 |
|
B |
65 |
20 |
18652 |
◊ |
B |
-x,-x+y,-z+1/3 |
9_555 |
65 |
20 |
18652 |
571.5 |
-3.1 |
0.367 |
4 |
8 |
0 |
0.096 |
5 |
|
C |
61 |
20 |
19124 |
◊ |
A |
-x,-x+y,-z+1/3 |
9_555 |
65 |
19 |
18625 |
554.8 |
-3.7 |
0.331 |
5 |
8 |
0 |
0.096 |
Average: |
563.1 |
-3.4 |
0.349 |
5 |
8 |
0 |
0.096 |
3 |
6 |
|
C |
61 |
19 |
19124 |
◊ |
A |
-y-1,-x-1,-z+1/6 |
10_445 |
65 |
18 |
18625 |
571.1 |
-1.7 |
0.495 |
9 |
7 |
0 |
0.065 |
4 |
7 |
|
A |
50 |
17 |
18625 |
◊ |
B |
x-y,x,z-1/6 |
6_554 |
53 |
16 |
18652 |
444.8 |
0.8 |
0.688 |
6 |
9 |
0 |
0.000 |
5 |
8 |
|
[AHR]C:1500 |
9 |
1 |
264 |
f |
C |
x,y,z |
1_555 |
21 |
12 |
19124 |
142.9 |
-1.0 |
0.402 |
4 |
0 |
0 |
0.091 |
9 |
|
[AHR]B:1501 |
9 |
1 |
265 |
f |
B |
x,y,z |
1_555 |
22 |
13 |
18652 |
124.4 |
-0.7 |
0.403 |
5 |
0 |
0 |
0.091 |
10 |
|
[AHR]A:1500 |
9 |
1 |
263 |
f |
A |
x,y,z |
1_555 |
21 |
13 |
18625 |
123.4 |
-0.7 |
0.393 |
5 |
0 |
0 |
0.091 |
Average: |
130.3 |
-0.8 |
0.399 |
5 |
0 |
0 |
0.091 |
6 |
11 |
|
[XYP]C:1498 |
9 |
1 |
261 |
f |
C |
x,y,z |
1_555 |
21 |
9 |
19124 |
137.7 |
-5.0 |
0.363 |
1 |
0 |
0 |
0.153 |
12 |
|
[XYP]A:1498 |
9 |
1 |
260 |
f |
A |
x,y,z |
1_555 |
27 |
11 |
18625 |
121.2 |
-4.2 |
0.365 |
1 |
0 |
0 |
0.153 |
13 |
|
[XYP]B:1499 |
9 |
1 |
259 |
f |
B |
x,y,z |
1_555 |
25 |
10 |
18652 |
120.5 |
-4.1 |
0.384 |
1 |
0 |
0 |
0.153 |
Average: |
126.5 |
-4.4 |
0.371 |
1 |
0 |
0 |
0.153 |
7 |
14 |
|
[XYP]B:1500 |
10 |
1 |
269 |
f |
B |
x,y,z |
1_555 |
24 |
9 |
18652 |
133.8 |
-0.8 |
0.683 |
1 |
0 |
0 |
0.025 |
15 |
|
[XYP]A:1499 |
10 |
1 |
270 |
f |
A |
x,y,z |
1_555 |
25 |
9 |
18625 |
133.2 |
-0.6 |
0.693 |
1 |
0 |
0 |
0.025 |
Average: |
133.5 |
-0.7 |
0.688 |
1 |
0 |
0 |
0.025 |
8 |
16 |
|
[XYP]C:1499 |
10 |
1 |
272 |
f |
C |
x,y,z |
1_555 |
23 |
8 |
19124 |
131.5 |
-0.8 |
0.701 |
1 |
0 |
0 |
0.013 |
9 |
17 |
|
[XYP]A:1497 |
8 |
1 |
262 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
18625 |
123.7 |
-2.7 |
0.363 |
0 |
0 |
0 |
0.061 |
18 |
|
[XYP]B:1498 |
9 |
1 |
261 |
f |
B |
x,y,z |
1_555 |
15 |
7 |
18652 |
122.7 |
-2.7 |
0.315 |
1 |
0 |
0 |
0.061 |
Average: |
123.2 |
-2.7 |
0.339 |
1 |
0 |
0 |
0.061 |
10 |
19 |
|
[PO4]C:1497 |
5 |
1 |
188 |
f |
C |
x,y,z |
1_555 |
16 |
6 |
19124 |
96.6 |
-6.8 |
0.648 |
2 |
0 |
0 |
0.081 |
11 |
20 |
|
[PO4]B:1497 |
5 |
1 |
189 |
f |
B |
x,y,z |
1_555 |
9 |
4 |
18652 |
60.6 |
-2.8 |
0.801 |
1 |
0 |
0 |
0.034 |
12 |
21 |
|
[PO4]B:1497 |
5 |
1 |
189 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
19124 |
59.6 |
-2.5 |
0.834 |
0 |
0 |
0 |
0.027 |
13 |
22 |
|
[PO4]B:1497 |
5 |
1 |
189 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
18625 |
58.4 |
-2.7 |
0.795 |
0 |
0 |
0 |
0.028 |
14 |
23 |
|
[XYP]C:1499 |
4 |
1 |
272 |
cf |
[XYP]C:1498 |
x,y,z |
1_555 |
4 |
1 |
261 |
53.2 |
-1.3 |
0.748 |
0 |
0 |
0 |
0.042 |
24 |
|
[XYP]A:1499 |
4 |
1 |
270 |
cf |
[XYP]A:1498 |
x,y,z |
1_555 |
4 |
1 |
260 |
47.8 |
-1.3 |
0.717 |
0 |
0 |
0 |
0.042 |
25 |
|
[XYP]B:1500 |
4 |
1 |
269 |
cf |
[XYP]B:1499 |
x,y,z |
1_555 |
5 |
1 |
259 |
47.3 |
-1.3 |
0.763 |
0 |
0 |
0 |
0.042 |
Average: |
49.4 |
-1.3 |
0.743 |
0 |
0 |
0 |
0.042 |
15 |
26 |
|
[AHR]C:1500 |
4 |
1 |
264 |
cf |
[XYP]C:1498 |
x,y,z |
1_555 |
5 |
1 |
261 |
50.3 |
-0.8 |
0.619 |
0 |
0 |
0 |
0.018 |
27 |
|
[AHR]B:1501 |
4 |
1 |
265 |
cf |
[XYP]B:1499 |
x,y,z |
1_555 |
5 |
1 |
259 |
42.5 |
-0.4 |
0.641 |
0 |
0 |
0 |
0.018 |
28 |
|
[AHR]A:1500 |
4 |
1 |
263 |
cf |
[XYP]A:1498 |
x,y,z |
1_555 |
4 |
1 |
260 |
42.5 |
-0.5 |
0.563 |
0 |
0 |
0 |
0.018 |
Average: |
45.1 |
-0.6 |
0.608 |
0 |
0 |
0 |
0.018 |
16 |
29 |
|
[XYP]A:1498 |
4 |
1 |
260 |
cf |
[XYP]A:1497 |
x,y,z |
1_555 |
4 |
1 |
262 |
48.0 |
-1.4 |
0.739 |
0 |
0 |
0 |
0.028 |
30 |
|
[XYP]B:1499 |
4 |
1 |
259 |
cf |
[XYP]B:1498 |
x,y,z |
1_555 |
4 |
1 |
261 |
47.1 |
-1.3 |
0.745 |
0 |
0 |
0 |
0.028 |
Average: |
47.5 |
-1.3 |
0.742 |
0 |
0 |
0 |
0.028 |
17 |
31 |
|
[PO4]C:1497 |
4 |
1 |
188 |
◊ |
A |
-y-1,-x-1,-z+1/6 |
10_445 |
5 |
3 |
18625 |
44.6 |
-2.5 |
0.688 |
0 |
0 |
0 |
0.023 |
18 |
32 |
|
A |
4 |
1 |
18625 |
◊ |
A |
-y-1,-x-1,-z+1/6 |
10_445 |
4 |
1 |
18625 |
29.5 |
-0.2 |
0.507 |
0 |
0 |
0 |
0.000 |
19 |
33 |
|
[AHR]A:1500 |
5 |
1 |
263 |
f |
[XYP]A:1497 |
x,y,z |
1_555 |
4 |
1 |
262 |
23.5 |
0.0 |
0.678 |
0 |
0 |
0 |
0.000 |
34 |
|
[AHR]B:1501 |
5 |
1 |
265 |
f |
[XYP]B:1498 |
x,y,z |
1_555 |
3 |
1 |
261 |
22.2 |
0.0 |
0.655 |
0 |
0 |
0 |
0.000 |
Average: |
22.8 |
0.0 |
0.666 |
0 |
0 |
0 |
0.000 |
20 |
35 |
|
[AHR]C:1500 |
1 |
1 |
264 |
f |
[XYP]C:1499 |
x,y,z |
1_555 |
1 |
1 |
272 |
4.8 |
0.0 |
0.596 |
0 |
0 |
0 |
0.000 |
21 |
36 |
|
[AHR]A:1500 |
1 |
1 |
263 |
f |
[XYP]A:1499 |
x,y,z |
1_555 |
1 |
1 |
270 |
4.3 |
0.0 |
0.596 |
0 |
0 |
0 |
0.000 |
37 |
|
[AHR]B:1501 |
1 |
1 |
265 |
f |
[XYP]B:1500 |
x,y,z |
1_555 |
1 |
1 |
269 |
4.1 |
0.0 |
0.596 |
0 |
0 |
0 |
0.000 |
Average: |
4.2 |
0.0 |
0.596 |
0 |
0 |
0 |
0.000 |
|