## |
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 |
270 |
69 |
15588 |
◊ |
A |
x,y,z |
1_555 |
298 |
71 |
15065 |
2709.6 |
-33.0 |
0.011 |
28 |
12 |
1 |
0.412 |
2 |
|
D |
278 |
71 |
15220 |
◊ |
C |
x,y,z |
1_555 |
276 |
72 |
15256 |
2700.0 |
-32.7 |
0.011 |
31 |
10 |
1 |
0.412 |
Average: |
2704.8 |
-32.9 |
0.011 |
30 |
11 |
1 |
0.412 |
2 |
3 |
|
A |
84 |
26 |
15065 |
◊ |
C |
-x,y-1/2,-z+2 |
2_547 |
85 |
26 |
15256 |
747.1 |
-6.9 |
0.228 |
4 |
1 |
0 |
0.041 |
3 |
4 |
|
E |
45 |
10 |
1200 |
◊ |
A |
x,y,z |
1_555 |
85 |
25 |
15065 |
722.6 |
-9.9 |
0.649 |
5 |
0 |
0 |
0.350 |
4 |
5 |
|
F |
50 |
11 |
1219 |
◊ |
B |
x,y,z |
1_555 |
99 |
30 |
15588 |
720.3 |
-13.3 |
0.522 |
3 |
1 |
0 |
0.363 |
6 |
|
G |
46 |
11 |
1188 |
◊ |
C |
x,y,z |
1_555 |
91 |
30 |
15256 |
711.9 |
-13.7 |
0.377 |
5 |
0 |
0 |
0.363 |
7 |
|
H |
50 |
11 |
1208 |
◊ |
D |
x,y,z |
1_555 |
92 |
28 |
15220 |
711.0 |
-13.6 |
0.442 |
3 |
0 |
0 |
0.363 |
Average: |
714.4 |
-13.6 |
0.447 |
4 |
0 |
0 |
0.363 |
5 |
8 |
|
B |
65 |
21 |
15588 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
76 |
22 |
15220 |
641.0 |
-6.2 |
0.228 |
3 |
2 |
0 |
0.000 |
6 |
9 |
|
D |
51 |
15 |
15220 |
◊ |
A |
x,y,z |
1_555 |
53 |
15 |
15065 |
408.0 |
-1.3 |
0.494 |
4 |
0 |
0 |
0.000 |
7 |
10 |
|
B |
38 |
12 |
15588 |
◊ |
C |
x,y-1,z |
1_545 |
40 |
12 |
15256 |
317.6 |
1.7 |
0.763 |
5 |
4 |
0 |
0.000 |
8 |
11 |
|
B |
39 |
14 |
15588 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
41 |
12 |
15065 |
315.3 |
-1.4 |
0.499 |
0 |
0 |
0 |
0.000 |
9 |
12 |
|
A |
24 |
5 |
15065 |
◊ |
D |
-x+1,y-1/2,-z+2 |
2_647 |
28 |
9 |
15220 |
241.5 |
0.1 |
0.601 |
2 |
3 |
0 |
0.025 |
13 |
|
B |
26 |
8 |
15588 |
◊ |
C |
-x+1,y-1/2,-z+2 |
2_647 |
25 |
5 |
15256 |
224.3 |
-1.9 |
0.396 |
2 |
0 |
0 |
0.025 |
Average: |
232.9 |
-0.9 |
0.498 |
2 |
2 |
0 |
0.025 |
10 |
14 |
|
E |
15 |
5 |
1200 |
◊ |
B |
x,y,z |
1_555 |
23 |
6 |
15588 |
186.1 |
-2.7 |
0.682 |
0 |
0 |
0 |
0.015 |
11 |
15 |
|
A |
19 |
6 |
15065 |
◊ |
B |
x-1,y,z |
1_455 |
17 |
5 |
15588 |
179.0 |
3.7 |
0.919 |
4 |
0 |
0 |
0.000 |
12 |
16 |
|
C |
19 |
6 |
15256 |
x |
C |
-x+1,y-1/2,-z+2 |
2_647 |
20 |
6 |
15256 |
173.0 |
1.7 |
0.773 |
6 |
5 |
0 |
0.000 |
13 |
17 |
|
B |
19 |
6 |
15588 |
◊ |
A |
x-1,y,z |
1_455 |
20 |
6 |
15065 |
167.7 |
0.1 |
0.516 |
1 |
0 |
0 |
0.000 |
18 |
|
D |
3 |
1 |
15220 |
◊ |
C |
x-1,y,z |
1_455 |
2 |
2 |
15256 |
21.1 |
0.2 |
0.562 |
0 |
0 |
0 |
0.000 |
Average: |
94.4 |
0.2 |
0.539 |
1 |
0 |
0 |
0.000 |
14 |
19 |
|
G |
15 |
5 |
1188 |
◊ |
D |
x,y,z |
1_555 |
15 |
5 |
15220 |
115.0 |
-2.6 |
0.448 |
0 |
0 |
0 |
0.025 |
20 |
|
F |
10 |
4 |
1219 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
15065 |
106.8 |
-2.1 |
0.538 |
0 |
0 |
0 |
0.025 |
21 |
|
H |
7 |
3 |
1208 |
◊ |
C |
x,y,z |
1_555 |
10 |
4 |
15256 |
65.8 |
-1.5 |
0.527 |
0 |
0 |
0 |
0.025 |
Average: |
95.9 |
-2.1 |
0.504 |
0 |
0 |
0 |
0.025 |
15 |
22 |
|
B |
11 |
6 |
15588 |
◊ |
D |
x,y-1,z |
1_545 |
11 |
4 |
15220 |
112.5 |
-0.2 |
0.552 |
1 |
0 |
0 |
0.000 |
16 |
23 |
|
[SO4]B:302 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
4 |
15588 |
98.2 |
-15.3 |
0.756 |
1 |
0 |
0 |
0.202 |
17 |
24 |
|
[SO4]A:303 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
17 |
6 |
15588 |
92.3 |
-14.0 |
0.618 |
1 |
0 |
0 |
0.186 |
18 |
25 |
|
[SO4]A:302 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
15065 |
86.5 |
-11.6 |
0.697 |
3 |
0 |
0 |
0.372 |
19 |
26 |
|
[SO4]C:303 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
16 |
6 |
15256 |
86.1 |
-13.1 |
0.578 |
1 |
0 |
0 |
0.308 |
20 |
27 |
|
C |
10 |
5 |
15256 |
◊ |
D |
x-1,y,z |
1_455 |
12 |
4 |
15220 |
82.5 |
1.0 |
0.749 |
1 |
2 |
0 |
0.000 |
21 |
28 |
|
[SO4]D:302 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
15220 |
82.1 |
-10.7 |
0.873 |
3 |
0 |
0 |
0.197 |
22 |
29 |
|
[SO4]A:301 |
5 |
1 |
184 |
f |
B |
x-1,y,z |
1_455 |
12 |
4 |
15588 |
80.0 |
-10.8 |
0.742 |
3 |
0 |
0 |
0.155 |
23 |
30 |
|
E |
7 |
3 |
1200 |
◊ |
C |
-x,y-1/2,-z+2 |
2_547 |
9 |
5 |
15256 |
79.3 |
-1.6 |
0.574 |
0 |
0 |
0 |
0.007 |
24 |
31 |
|
[SO4]D:303 |
5 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
12 |
4 |
15220 |
77.2 |
-10.0 |
0.817 |
4 |
0 |
0 |
0.193 |
25 |
32 |
|
[SO4]D:304 |
5 |
1 |
185 |
f |
D |
x,y,z |
1_555 |
16 |
6 |
15220 |
76.5 |
-10.5 |
0.801 |
2 |
0 |
0 |
0.187 |
26 |
33 |
|
[SO4]D:301 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
15 |
6 |
15220 |
71.1 |
-9.5 |
0.848 |
3 |
0 |
0 |
0.178 |
27 |
34 |
|
[SO4]B:301 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
15588 |
70.3 |
-9.1 |
0.872 |
3 |
0 |
0 |
0.133 |
28 |
35 |
|
B |
6 |
4 |
15588 |
f |
[SO4]C:301 |
x,y-1,z |
1_545 |
5 |
1 |
185 |
69.3 |
-9.6 |
0.678 |
2 |
0 |
0 |
0.134 |
29 |
36 |
|
A |
10 |
4 |
15065 |
◊ |
G |
-x,y-1/2,-z+2 |
2_547 |
8 |
4 |
1188 |
69.2 |
-0.6 |
0.738 |
0 |
0 |
0 |
0.002 |
30 |
37 |
|
[SO4]C:302 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
9 |
3 |
15256 |
67.2 |
-9.3 |
0.542 |
1 |
0 |
0 |
0.221 |
31 |
38 |
|
[SO4]A:304 |
4 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
15065 |
64.8 |
-9.2 |
0.521 |
1 |
0 |
0 |
0.277 |
32 |
39 |
|
[SO4]A:301 |
5 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
15065 |
64.0 |
-7.3 |
0.925 |
2 |
0 |
0 |
0.038 |
33 |
40 |
|
F |
9 |
2 |
1219 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
7 |
2 |
15220 |
63.5 |
-1.0 |
0.636 |
0 |
0 |
0 |
0.000 |
34 |
41 |
|
C |
8 |
3 |
15256 |
◊ |
[SO4]D:302 |
x-1,y,z |
1_455 |
4 |
1 |
185 |
61.8 |
-7.5 |
0.868 |
3 |
0 |
0 |
0.041 |
35 |
42 |
|
[SO4]A:303 |
5 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
15065 |
57.8 |
-8.3 |
0.481 |
3 |
0 |
0 |
0.065 |
36 |
43 |
|
B |
10 |
3 |
15588 |
◊ |
[SO4]C:302 |
-x+1,y-1/2,-z+2 |
2_647 |
4 |
1 |
186 |
57.1 |
-7.9 |
0.617 |
2 |
0 |
0 |
0.080 |
37 |
44 |
|
[SO4]C:301 |
5 |
1 |
185 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
15256 |
56.7 |
-6.9 |
0.911 |
2 |
0 |
0 |
0.000 |
38 |
45 |
|
[SO4]A:304 |
4 |
1 |
186 |
◊ |
D |
-x+1,y-1/2,-z+2 |
2_647 |
10 |
3 |
15220 |
54.9 |
-7.5 |
0.644 |
2 |
0 |
0 |
0.102 |
39 |
46 |
|
B |
8 |
2 |
15588 |
◊ |
[SO4]C:303 |
-x+1,y-1/2,-z+2 |
2_647 |
4 |
1 |
185 |
44.7 |
-5.7 |
0.635 |
0 |
0 |
0 |
0.052 |
40 |
47 |
|
A |
8 |
5 |
15065 |
◊ |
C |
x,y-1,z |
1_545 |
9 |
5 |
15256 |
42.2 |
0.4 |
0.677 |
0 |
0 |
0 |
0.000 |
41 |
48 |
|
[SO4]D:304 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
15065 |
41.4 |
-5.0 |
0.655 |
0 |
0 |
0 |
0.001 |
42 |
49 |
|
[SO4]C:303 |
3 |
1 |
185 |
f |
[SO4]C:302 |
x,y,z |
1_555 |
4 |
1 |
186 |
21.4 |
-4.7 |
0.995 |
0 |
0 |
0 |
0.108 |
43 |
50 |
|
A |
3 |
2 |
15065 |
◊ |
[SO4]D:303 |
-x+1,y-1/2,-z+2 |
2_647 |
2 |
1 |
184 |
20.3 |
-1.8 |
0.935 |
1 |
0 |
0 |
0.027 |
44 |
51 |
|
[SO4]D:304 |
2 |
1 |
185 |
◊ |
[SO4]A:302 |
x,y,z |
1_555 |
4 |
1 |
185 |
18.8 |
-4.3 |
0.979 |
0 |
0 |
0 |
0.001 |
45 |
52 |
|
[SO4]A:301 |
4 |
1 |
184 |
◊ |
C |
-x,y-1/2,-z+2 |
2_547 |
2 |
2 |
15256 |
15.6 |
-1.5 |
0.816 |
0 |
0 |
0 |
0.014 |
46 |
53 |
|
[SO4]B:302 |
3 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
15065 |
13.9 |
-1.4 |
0.908 |
0 |
0 |
0 |
0.009 |
47 |
54 |
|
A |
3 |
1 |
15065 |
◊ |
[SO4]D:302 |
-x+1,y-1/2,-z+2 |
2_647 |
1 |
1 |
185 |
12.5 |
-1.4 |
0.759 |
0 |
0 |
0 |
0.017 |
48 |
55 |
|
[SO4]A:302 |
2 |
1 |
185 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
15220 |
6.3 |
-0.6 |
0.884 |
0 |
0 |
0 |
0.000 |
49 |
56 |
|
D |
1 |
1 |
15220 |
x |
D |
x-1,y,z |
1_455 |
4 |
1 |
15220 |
6.3 |
0.1 |
0.694 |
0 |
0 |
0 |
0.000 |
|