## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
C |
81 |
22 |
12038 |
◊ |
A |
x-1/2,-y+3/2,-z+1 |
4_466 |
83 |
24 |
11989 |
745.8 |
-3.2 |
0.440 |
7 |
7 |
0 |
0.000 |
2 |
|
D |
72 |
20 |
11881 |
◊ |
B |
x,y,z |
1_555 |
71 |
18 |
12043 |
626.0 |
-6.0 |
0.241 |
5 |
5 |
0 |
0.000 |
3 |
|
D |
69 |
19 |
11881 |
◊ |
C |
x,y,z |
1_555 |
60 |
17 |
12038 |
588.3 |
-2.3 |
0.613 |
4 |
2 |
0 |
0.000 |
4 |
|
D |
66 |
18 |
11881 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
53 |
14 |
12043 |
580.4 |
-3.7 |
0.500 |
6 |
0 |
0 |
0.000 |
5 |
|
A |
55 |
14 |
11989 |
◊ |
B |
-x+1,y-1/2,-z+3/2 |
3_646 |
55 |
14 |
12043 |
536.0 |
-1.2 |
0.613 |
4 |
3 |
0 |
0.000 |
6 |
|
A |
53 |
16 |
11989 |
◊ |
C |
-x+1,y-1/2,-z+3/2 |
3_646 |
53 |
16 |
12038 |
487.3 |
-5.7 |
0.359 |
6 |
0 |
0 |
0.000 |
7 |
|
D |
46 |
15 |
11881 |
◊ |
C |
-x+1,y-1/2,-z+3/2 |
3_646 |
49 |
15 |
12038 |
449.0 |
-1.0 |
0.690 |
4 |
4 |
0 |
0.000 |
8 |
|
D |
52 |
15 |
11881 |
◊ |
A |
x-1,y,z |
1_455 |
48 |
14 |
11989 |
439.1 |
-2.1 |
0.616 |
1 |
2 |
0 |
0.000 |
9 |
|
C |
52 |
15 |
12038 |
◊ |
B |
x,y,z |
1_555 |
41 |
14 |
12043 |
409.4 |
-4.0 |
0.402 |
2 |
0 |
0 |
0.000 |
10 |
|
D |
31 |
8 |
11881 |
◊ |
A |
x,y,z |
1_555 |
43 |
14 |
11989 |
351.5 |
2.0 |
0.877 |
3 |
0 |
0 |
0.000 |
11 |
|
B |
34 |
10 |
12043 |
x |
B |
x-1/2,-y+3/2,-z+2 |
4_467 |
31 |
12 |
12043 |
263.5 |
-0.4 |
0.559 |
3 |
0 |
0 |
0.000 |
12 |
|
[J3G]B:302 |
16 |
1 |
465 |
◊ |
B |
x,y,z |
1_555 |
25 |
9 |
12043 |
220.1 |
2.1 |
0.269 |
4 |
0 |
0 |
0.000 |
13 |
|
D |
23 |
7 |
11881 |
◊ |
C |
-x,y-1/2,-z+3/2 |
3_546 |
20 |
5 |
12038 |
188.1 |
1.5 |
0.815 |
5 |
1 |
0 |
0.000 |
14 |
|
A |
20 |
8 |
11989 |
◊ |
B |
-x+3/2,-y+1,z-1/2 |
2_664 |
17 |
5 |
12043 |
175.1 |
0.2 |
0.715 |
3 |
0 |
0 |
0.000 |
15 |
|
[ABU]D:301 |
6 |
1 |
239 |
f |
D |
x,y,z |
1_555 |
23 |
13 |
11881 |
159.7 |
-3.1 |
0.472 |
2 |
0 |
0 |
0.014 |
16 |
|
[ABU]C:301 |
6 |
1 |
236 |
f |
C |
x,y,z |
1_555 |
27 |
14 |
12038 |
157.6 |
-2.8 |
0.509 |
3 |
0 |
0 |
0.017 |
17 |
|
[GOL]D:304 |
6 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
22 |
11 |
11881 |
148.9 |
-1.2 |
0.437 |
1 |
0 |
0 |
0.006 |
18 |
|
[GOL]A:301 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
19 |
10 |
11989 |
142.8 |
-1.2 |
0.492 |
1 |
0 |
0 |
0.074 |
19 |
|
[J3J]A:304 |
10 |
1 |
340 |
f |
A |
x,y,z |
1_555 |
16 |
5 |
11989 |
129.6 |
4.2 |
0.351 |
3 |
0 |
0 |
0.000 |
20 |
|
[EDO]B:301 |
4 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
29 |
11 |
12043 |
121.9 |
2.4 |
0.431 |
1 |
0 |
0 |
0.000 |
21 |
|
C |
16 |
4 |
12038 |
◊ |
A |
x,y,z |
1_555 |
16 |
4 |
11989 |
120.2 |
-1.6 |
0.414 |
1 |
0 |
0 |
0.000 |
22 |
|
[GOL]A:302 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
16 |
7 |
11989 |
118.2 |
-0.5 |
0.562 |
2 |
0 |
0 |
0.065 |
23 |
|
[EDO]C:305 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
18 |
9 |
12038 |
118.2 |
2.8 |
0.431 |
1 |
0 |
0 |
0.000 |
24 |
|
[SO4]D:302 |
5 |
1 |
186 |
f |
D |
x,y,z |
1_555 |
13 |
5 |
11881 |
110.4 |
-13.5 |
0.846 |
4 |
0 |
0 |
0.052 |
25 |
|
[GOL]A:303 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
11989 |
98.3 |
-0.7 |
0.474 |
3 |
0 |
0 |
0.094 |
26 |
|
C |
11 |
6 |
12038 |
◊ |
[GOL]A:303 |
x-1/2,-y+3/2,-z+1 |
4_466 |
5 |
1 |
222 |
85.3 |
-1.0 |
0.411 |
1 |
0 |
0 |
0.000 |
27 |
|
[J3J]A:304 |
7 |
1 |
340 |
◊ |
C |
-x+1,y-1/2,-z+3/2 |
3_646 |
12 |
5 |
12038 |
81.6 |
1.7 |
0.234 |
1 |
0 |
0 |
0.000 |
28 |
|
[SO4]C:302 |
5 |
1 |
187 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
12038 |
80.8 |
-11.0 |
0.851 |
2 |
0 |
0 |
0.049 |
29 |
|
[PO4]B:303 |
5 |
1 |
188 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
12043 |
80.0 |
-4.6 |
0.771 |
1 |
0 |
0 |
0.175 |
30 |
|
[EDO]C:304 |
4 |
1 |
185 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
12038 |
70.6 |
1.6 |
0.822 |
0 |
0 |
0 |
0.000 |
31 |
|
D |
10 |
5 |
11881 |
◊ |
[PO4]B:303 |
-x+1/2,-y+1,z-1/2 |
2_564 |
4 |
1 |
188 |
65.8 |
-4.0 |
0.758 |
1 |
0 |
0 |
0.000 |
32 |
|
[SO4]C:303 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
13 |
4 |
12038 |
64.3 |
-8.6 |
0.744 |
1 |
0 |
0 |
0.037 |
33 |
|
[SO4]D:303 |
4 |
1 |
187 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
11881 |
61.0 |
-8.0 |
0.815 |
1 |
0 |
0 |
0.029 |
34 |
|
[SO4]D:302 |
5 |
1 |
186 |
◊ |
C |
-x+1,y-1/2,-z+3/2 |
3_646 |
4 |
2 |
12038 |
43.7 |
-4.8 |
0.695 |
0 |
0 |
0 |
0.000 |
35 |
|
D |
6 |
3 |
11881 |
◊ |
[GOL]A:302 |
x-1,y,z |
1_455 |
3 |
1 |
221 |
35.7 |
-0.3 |
0.496 |
0 |
0 |
0 |
0.000 |
36 |
|
A |
3 |
2 |
11989 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
8 |
3 |
12043 |
26.4 |
0.7 |
0.819 |
0 |
0 |
0 |
0.000 |
37 |
|
[SO4]C:303 |
1 |
1 |
186 |
f |
[EDO]C:304 |
x,y,z |
1_555 |
1 |
1 |
185 |
24.2 |
-2.6 |
0.894 |
1 |
0 |
0 |
0.013 |
38 |
|
B |
4 |
1 |
12043 |
f |
[J3G]B:302 |
x-1/2,-y+3/2,-z+2 |
4_467 |
3 |
1 |
465 |
20.5 |
0.2 |
0.357 |
0 |
0 |
0 |
0.000 |
39 |
|
[ABU]D:301 |
1 |
1 |
239 |
f |
[GOL]D:304 |
x,y,z |
1_555 |
1 |
1 |
220 |
19.1 |
-0.1 |
0.577 |
0 |
0 |
0 |
0.000 |
40 |
|
[GOL]A:302 |
1 |
1 |
221 |
◊ |
C |
-x+1,y-1/2,-z+3/2 |
3_646 |
3 |
1 |
12038 |
11.6 |
0.2 |
0.612 |
0 |
0 |
0 |
0.000 |
41 |
|
D |
1 |
1 |
11881 |
◊ |
[J3J]A:304 |
x-1,y,z |
1_455 |
2 |
1 |
340 |
7.2 |
0.5 |
0.390 |
0 |
0 |
0 |
0.000 |
42 |
|
[J3J]A:304 |
1 |
1 |
340 |
f |
[GOL]A:302 |
x,y,z |
1_555 |
2 |
1 |
221 |
1.4 |
-0.0 |
0.326 |
0 |
0 |
0 |
0.000 |
|