## |
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 |
182 |
47 |
13368 |
◊ |
C |
x,y,z |
1_555 |
188 |
50 |
13385 |
1854.1 |
-11.2 |
0.145 |
34 |
20 |
0 |
0.533 |
2 |
|
B |
185 |
48 |
13351 |
◊ |
A |
x,y,z |
1_555 |
186 |
48 |
13402 |
1851.5 |
-11.0 |
0.150 |
35 |
16 |
0 |
0.533 |
3 |
|
F |
187 |
49 |
13391 |
◊ |
E |
x,y,z |
1_555 |
182 |
49 |
13387 |
1846.6 |
-10.9 |
0.154 |
35 |
18 |
0 |
0.533 |
Average: |
1850.7 |
-11.1 |
0.150 |
35 |
18 |
0 |
0.533 |
2 |
4 |
|
B |
71 |
18 |
13351 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
66 |
16 |
13385 |
656.2 |
-3.1 |
0.337 |
7 |
0 |
0 |
0.000 |
5 |
|
E |
68 |
18 |
13387 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
65 |
17 |
13368 |
643.2 |
-2.9 |
0.353 |
6 |
0 |
0 |
0.000 |
6 |
|
A |
66 |
18 |
13402 |
◊ |
F |
x-1,y,z |
1_455 |
64 |
18 |
13391 |
618.8 |
-3.3 |
0.317 |
6 |
0 |
0 |
0.000 |
Average: |
639.4 |
-3.1 |
0.336 |
6 |
0 |
0 |
0.000 |
3 |
7 |
|
B |
39 |
9 |
13351 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
53 |
14 |
13368 |
433.8 |
4.6 |
0.722 |
4 |
8 |
0 |
0.000 |
4 |
8 |
|
E |
50 |
13 |
13387 |
x |
A |
-x+1,y-1/2,-z |
2_645 |
48 |
13 |
13402 |
388.1 |
-3.1 |
0.299 |
5 |
0 |
0 |
0.000 |
9 |
|
C |
49 |
13 |
13385 |
x |
C |
-x+2,y-1/2,-z+1 |
2_746 |
52 |
13 |
13385 |
385.6 |
-3.1 |
0.301 |
5 |
0 |
0 |
0.000 |
Average: |
386.8 |
-3.1 |
0.300 |
5 |
0 |
0 |
0.000 |
5 |
10 |
|
F |
33 |
11 |
13391 |
◊ |
D |
x,y,z |
1_555 |
34 |
13 |
13368 |
287.6 |
-2.3 |
0.318 |
2 |
0 |
0 |
0.000 |
6 |
11 |
|
[AMP]C:301 |
18 |
1 |
494 |
f |
C |
x,y,z |
1_555 |
25 |
7 |
13385 |
198.9 |
-0.6 |
0.588 |
2 |
0 |
0 |
0.100 |
12 |
|
[AMP]C:303 |
18 |
1 |
493 |
f |
D |
x,y,z |
1_555 |
27 |
7 |
13368 |
198.4 |
-0.6 |
0.590 |
2 |
0 |
0 |
0.100 |
13 |
|
[AMP]A:301 |
18 |
1 |
494 |
f |
A |
x,y,z |
1_555 |
26 |
7 |
13402 |
196.6 |
-0.6 |
0.584 |
2 |
0 |
0 |
0.100 |
14 |
|
[AMP]A:303 |
18 |
1 |
492 |
f |
B |
x,y,z |
1_555 |
26 |
7 |
13351 |
195.5 |
-0.5 |
0.594 |
2 |
0 |
0 |
0.100 |
15 |
|
[AMP]F:301 |
18 |
1 |
494 |
f |
E |
x,y,z |
1_555 |
27 |
7 |
13387 |
193.8 |
-0.7 |
0.590 |
2 |
0 |
0 |
0.100 |
16 |
|
[AMP]E:302 |
18 |
1 |
490 |
f |
F |
x,y,z |
1_555 |
26 |
7 |
13391 |
193.7 |
-0.7 |
0.585 |
2 |
0 |
0 |
0.100 |
Average: |
196.1 |
-0.6 |
0.589 |
2 |
0 |
0 |
0.100 |
7 |
17 |
|
E |
20 |
5 |
13387 |
◊ |
A |
x,y,z |
1_555 |
22 |
8 |
13402 |
170.0 |
-0.5 |
0.485 |
1 |
0 |
0 |
0.004 |
8 |
18 |
|
A |
22 |
10 |
13402 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
16 |
4 |
13385 |
158.4 |
0.2 |
0.569 |
0 |
2 |
0 |
0.000 |
9 |
19 |
|
F |
20 |
6 |
13391 |
◊ |
C |
x,y-1,z |
1_545 |
14 |
3 |
13385 |
155.2 |
0.8 |
0.652 |
1 |
1 |
0 |
0.000 |
10 |
20 |
|
[AMP]E:302 |
12 |
1 |
490 |
◊ |
E |
x,y,z |
1_555 |
19 |
5 |
13387 |
127.6 |
0.5 |
0.454 |
2 |
0 |
0 |
0.015 |
21 |
|
[AMP]F:301 |
12 |
1 |
494 |
◊ |
F |
x,y,z |
1_555 |
18 |
5 |
13391 |
124.0 |
0.8 |
0.471 |
2 |
0 |
0 |
0.015 |
22 |
|
[AMP]A:303 |
12 |
1 |
492 |
◊ |
A |
x,y,z |
1_555 |
17 |
5 |
13402 |
123.6 |
0.5 |
0.437 |
2 |
0 |
0 |
0.015 |
23 |
|
[AMP]C:303 |
12 |
1 |
493 |
◊ |
C |
x,y,z |
1_555 |
18 |
5 |
13385 |
121.0 |
0.3 |
0.428 |
2 |
0 |
0 |
0.015 |
24 |
|
[AMP]A:301 |
12 |
1 |
494 |
◊ |
B |
x,y,z |
1_555 |
16 |
5 |
13351 |
120.2 |
0.7 |
0.460 |
2 |
0 |
0 |
0.015 |
25 |
|
[AMP]C:301 |
12 |
1 |
494 |
◊ |
D |
x,y,z |
1_555 |
16 |
5 |
13368 |
114.5 |
0.7 |
0.471 |
2 |
0 |
0 |
0.015 |
Average: |
121.8 |
0.6 |
0.454 |
2 |
0 |
0 |
0.015 |
11 |
26 |
|
[SO4]C:302 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
19 |
10 |
13385 |
114.0 |
-16.2 |
0.716 |
11 |
0 |
0 |
0.383 |
12 |
27 |
|
[SO4]B:301 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
19 |
10 |
13351 |
113.5 |
-16.1 |
0.713 |
11 |
0 |
0 |
0.434 |
13 |
28 |
|
[SO4]A:302 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
13402 |
113.3 |
-16.2 |
0.718 |
12 |
0 |
0 |
0.265 |
14 |
29 |
|
[SO4]F:302 |
5 |
1 |
186 |
f |
F |
x,y,z |
1_555 |
20 |
10 |
13391 |
113.1 |
-16.1 |
0.713 |
11 |
0 |
0 |
0.384 |
15 |
30 |
|
[SO4]E:301 |
5 |
1 |
186 |
◊ |
E |
x,y,z |
1_555 |
20 |
9 |
13387 |
112.6 |
-16.0 |
0.806 |
11 |
0 |
0 |
0.892 |
31 |
|
[SO4]D:301 |
5 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
17 |
10 |
13368 |
105.1 |
-14.7 |
0.719 |
12 |
0 |
0 |
0.892 |
Average: |
108.9 |
-15.3 |
0.763 |
12 |
0 |
0 |
0.892 |
16 |
32 |
|
A |
11 |
5 |
13402 |
◊ |
C |
x-1,y,z |
1_455 |
6 |
1 |
13385 |
92.2 |
1.8 |
0.808 |
0 |
6 |
0 |
0.000 |
17 |
33 |
|
C |
6 |
2 |
13385 |
◊ |
B |
x,y,z |
1_555 |
8 |
2 |
13351 |
52.7 |
-0.0 |
0.582 |
0 |
0 |
0 |
0.000 |
34 |
|
D |
9 |
2 |
13368 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
13402 |
50.7 |
-0.2 |
0.541 |
0 |
0 |
0 |
0.000 |
Average: |
51.7 |
-0.1 |
0.562 |
0 |
0 |
0 |
0.000 |
18 |
35 |
|
A |
7 |
3 |
13402 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
7 |
2 |
13351 |
47.3 |
-0.1 |
0.462 |
0 |
0 |
0 |
0.000 |
19 |
36 |
|
B |
3 |
1 |
13351 |
cf |
[SO4]D:301 |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
185 |
47.3 |
-4.1 |
0.957 |
0 |
0 |
0 |
0.084 |
20 |
37 |
|
E |
3 |
1 |
13387 |
x |
E |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
13387 |
32.1 |
0.9 |
0.875 |
1 |
2 |
0 |
0.000 |
21 |
38 |
|
F |
3 |
1 |
13391 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
13351 |
25.8 |
0.5 |
0.752 |
0 |
0 |
0 |
0.000 |
22 |
39 |
|
[AMP]F:301 |
5 |
1 |
494 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
13402 |
21.1 |
-0.1 |
0.657 |
0 |
0 |
0 |
0.000 |
23 |
40 |
|
[SO4]B:301 |
2 |
1 |
186 |
f |
[AMP]A:303 |
x,y,z |
1_555 |
2 |
1 |
492 |
7.8 |
-1.0 |
0.622 |
0 |
0 |
0 |
0.021 |
24 |
41 |
|
[SO4]A:302 |
2 |
1 |
185 |
f |
[AMP]A:301 |
x,y,z |
1_555 |
2 |
1 |
494 |
6.8 |
-1.0 |
0.622 |
0 |
0 |
0 |
0.012 |
25 |
42 |
|
[SO4]D:301 |
2 |
1 |
185 |
◊ |
[AMP]C:303 |
x,y,z |
1_555 |
2 |
1 |
493 |
6.5 |
-0.8 |
0.622 |
0 |
0 |
0 |
0.039 |
43 |
|
[SO4]E:301 |
2 |
1 |
186 |
◊ |
[AMP]F:301 |
x,y,z |
1_555 |
2 |
1 |
494 |
6.3 |
-0.9 |
0.613 |
0 |
0 |
0 |
0.039 |
Average: |
6.4 |
-0.9 |
0.617 |
0 |
0 |
0 |
0.039 |
26 |
44 |
|
[SO4]C:302 |
2 |
1 |
185 |
f |
[AMP]C:301 |
x,y,z |
1_555 |
2 |
1 |
494 |
6.2 |
-0.8 |
0.622 |
0 |
0 |
0 |
0.015 |
27 |
45 |
|
[SO4]F:302 |
2 |
1 |
186 |
f |
[AMP]E:302 |
x,y,z |
1_555 |
2 |
1 |
490 |
6.0 |
-0.9 |
0.622 |
0 |
0 |
0 |
0.016 |
28 |
46 |
|
E |
1 |
1 |
13387 |
◊ |
F |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
13391 |
3.9 |
0.0 |
0.533 |
0 |
0 |
0 |
0.000 |
|