| ## |
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 |
|
F |
60 |
15 |
4818 |
◊ |
D |
x,y,z |
1_555 |
67 |
18 |
4892 |
618.3 |
-7.4 |
0.285 |
7 |
5 |
0 |
0.000 |
2 |
|
E |
64 |
17 |
5007 |
◊ |
C |
x,y,z |
1_555 |
52 |
15 |
4921 |
566.4 |
-3.8 |
0.456 |
4 |
3 |
0 |
0.000 |
3 |
|
C |
66 |
16 |
4921 |
◊ |
A |
x,y,z |
1_555 |
55 |
15 |
4959 |
541.0 |
-6.3 |
0.316 |
3 |
0 |
0 |
0.000 |
4 |
|
D |
58 |
15 |
4892 |
◊ |
B |
x,y,z |
1_555 |
62 |
17 |
5082 |
533.5 |
-4.3 |
0.432 |
5 |
3 |
0 |
0.000 |
| Average: |
564.8 |
-5.4 |
0.372 |
5 |
3 |
0 |
0.000 |
| 2 |
5 |
|
F |
73 |
19 |
4818 |
◊ |
E |
x,y,z |
1_555 |
71 |
20 |
5007 |
616.8 |
-10.6 |
0.153 |
8 |
0 |
0 |
0.474 |
6 |
|
B |
75 |
20 |
5082 |
◊ |
A |
x,y,z |
1_555 |
66 |
17 |
4959 |
613.6 |
-9.9 |
0.149 |
7 |
0 |
0 |
0.474 |
7 |
|
D |
65 |
18 |
4892 |
◊ |
C |
x,y,z |
1_555 |
71 |
20 |
4921 |
604.0 |
-9.3 |
0.205 |
10 |
0 |
0 |
0.474 |
| Average: |
611.5 |
-9.9 |
0.169 |
8 |
0 |
0 |
0.474 |
| 3 |
8 |
|
F |
60 |
15 |
4818 |
◊ |
A |
x-y,x,z+1/3 |
6_555 |
61 |
17 |
4959 |
546.9 |
-5.3 |
0.377 |
6 |
0 |
0 |
0.151 |
| 4 |
9 |
|
B |
43 |
12 |
5082 |
◊ |
B |
-x,-y+1,z |
4_565 |
43 |
12 |
5082 |
405.5 |
-0.5 |
0.604 |
8 |
0 |
0 |
0.000 |
10 |
|
E |
47 |
12 |
5007 |
◊ |
E |
-x-1,-y,z |
4_455 |
47 |
12 |
5007 |
378.4 |
-2.4 |
0.521 |
4 |
0 |
0 |
0.000 |
| Average: |
392.0 |
-1.4 |
0.562 |
6 |
0 |
0 |
0.000 |
| 5 |
11 |
|
C |
25 |
10 |
4921 |
◊ |
B |
x,y,z |
1_555 |
20 |
9 |
5082 |
148.6 |
-0.4 |
0.608 |
0 |
0 |
0 |
0.000 |
12 |
|
E |
20 |
8 |
5007 |
◊ |
D |
x,y,z |
1_555 |
15 |
6 |
4892 |
120.9 |
-0.0 |
0.652 |
0 |
0 |
0 |
0.000 |
| Average: |
134.7 |
-0.2 |
0.630 |
0 |
0 |
0 |
0.000 |
| 6 |
13 |
|
[SO4]C:101 |
5 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
10 |
3 |
4921 |
84.0 |
-10.2 |
0.914 |
3 |
0 |
0 |
0.398 |
| 7 |
14 |
|
[SO4]F:101 |
5 |
1 |
185 |
f |
F |
x,y,z |
1_555 |
11 |
3 |
4818 |
76.0 |
-11.2 |
0.624 |
2 |
0 |
0 |
0.301 |
| 8 |
15 |
|
[SO4]B:101 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
11 |
4 |
5082 |
72.9 |
-10.5 |
0.597 |
1 |
0 |
0 |
0.228 |
| 9 |
16 |
|
[SO4]E:101 |
5 |
1 |
185 |
f |
E |
x,y,z |
1_555 |
9 |
4 |
5007 |
69.8 |
-10.1 |
0.591 |
2 |
0 |
0 |
0.273 |
| 10 |
17 |
|
[SO4]A:104 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
4959 |
57.2 |
-6.9 |
0.780 |
2 |
0 |
0 |
0.164 |
| 11 |
18 |
|
[SO4]A:103 |
5 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
4959 |
52.4 |
-7.4 |
0.707 |
2 |
0 |
0 |
0.173 |
| 12 |
19 |
|
[SO4]B:103 |
4 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
5082 |
48.2 |
-4.9 |
0.899 |
0 |
0 |
0 |
0.102 |
| 13 |
20 |
|
F |
4 |
1 |
4818 |
◊ |
[SO4]A:104 |
x-y,x,z+1/3 |
6_555 |
4 |
1 |
185 |
36.7 |
-4.8 |
0.495 |
0 |
0 |
0 |
0.091 |
| 14 |
21 |
|
[SO4]C:102 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
4 |
3 |
4921 |
32.4 |
-3.7 |
0.836 |
0 |
0 |
0 |
0.127 |
| 15 |
22 |
|
F |
4 |
1 |
4818 |
◊ |
E |
-x-1,-y,z |
4_455 |
3 |
2 |
5007 |
32.2 |
-0.7 |
0.303 |
0 |
0 |
0 |
0.000 |
23 |
|
B |
1 |
1 |
5082 |
◊ |
A |
-x,-y+1,z |
4_565 |
1 |
1 |
4959 |
11.2 |
0.0 |
0.464 |
0 |
0 |
0 |
0.000 |
| Average: |
21.7 |
-0.3 |
0.384 |
0 |
0 |
0 |
0.000 |
| 16 |
24 |
|
[SO4]B:102 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
2 |
1 |
5082 |
30.8 |
-2.4 |
0.961 |
2 |
0 |
0 |
0.000 |
| 17 |
25 |
|
F |
7 |
4 |
4818 |
f |
[SO4]A:101 |
x-y,x,z+1/3 |
6_555 |
4 |
1 |
185 |
26.6 |
-3.0 |
0.796 |
0 |
0 |
0 |
0.074 |
| 18 |
26 |
|
[SO4]A:101 |
4 |
1 |
185 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
4959 |
21.4 |
-2.1 |
0.836 |
0 |
0 |
0 |
0.039 |
| 19 |
27 |
|
[SO4]A:102 |
3 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
5 |
2 |
4959 |
20.7 |
-2.9 |
0.681 |
0 |
0 |
0 |
0.061 |
| 20 |
28 |
|
F |
1 |
1 |
4818 |
◊ |
F |
-x-1,-y,z |
4_455 |
1 |
1 |
4818 |
15.3 |
0.3 |
0.845 |
0 |
0 |
0 |
0.000 |
| 21 |
29 |
|
[SO4]F:101 |
1 |
1 |
185 |
◊ |
[SO4]A:104 |
x-y,x,z+1/3 |
6_555 |
3 |
1 |
185 |
14.3 |
-3.4 |
0.891 |
0 |
0 |
0 |
0.064 |
| 22 |
30 |
|
[SO4]E:101 |
1 |
1 |
185 |
◊ |
E |
-x-1,-y,z |
4_455 |
3 |
1 |
5007 |
11.6 |
-1.4 |
0.749 |
0 |
0 |
0 |
0.000 |
| 23 |
31 |
|
[SO4]B:102 |
1 |
1 |
185 |
◊ |
B |
-x,-y+1,z |
4_565 |
1 |
1 |
5082 |
7.5 |
-0.8 |
0.791 |
0 |
0 |
0 |
0.000 |
| 24 |
32 |
|
[SO4]A:102 |
1 |
1 |
186 |
◊ |
B |
-x,-y+1,z |
4_565 |
2 |
2 |
5082 |
6.0 |
-0.8 |
0.627 |
0 |
0 |
0 |
0.000 |
| 25 |
33 |
|
F |
2 |
1 |
4818 |
◊ |
[SO4]A:103 |
x-y,x,z+1/3 |
6_555 |
1 |
1 |
184 |
5.4 |
-0.6 |
0.751 |
0 |
0 |
0 |
0.011 |
| 26 |
34 |
|
[SO4]F:101 |
1 |
1 |
185 |
◊ |
A |
x-y,x,z+1/3 |
6_555 |
1 |
1 |
4959 |
2.1 |
-0.2 |
0.896 |
0 |
0 |
0 |
0.003 |
| 27 |
35 |
|
[SO4]B:101 |
1 |
1 |
186 |
◊ |
B |
-x,-y+1,z |
4_565 |
1 |
1 |
5082 |
1.0 |
-0.1 |
0.836 |
0 |
0 |
0 |
0.000 |
|