| ## |
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 |
100 |
30 |
11408 |
◊ |
A |
x,y,z |
1_555 |
100 |
30 |
11126 |
932.8 |
4.6 |
0.830 |
16 |
16 |
0 |
0.041 |
| 2 |
2 |
|
B |
46 |
10 |
11408 |
◊ |
A |
x-y,x-1,z+1/3 |
6_545 |
63 |
18 |
11126 |
509.2 |
-3.4 |
0.293 |
6 |
4 |
0 |
0.058 |
| 3 |
3 |
|
B |
32 |
10 |
11408 |
◊ |
A |
-x+1,-y,z |
4_655 |
28 |
8 |
11126 |
276.2 |
-0.9 |
0.447 |
2 |
1 |
0 |
0.000 |
| 4 |
4 |
|
A |
28 |
7 |
11126 |
x |
A |
-y+1,x-y,z-1/3 |
2_654 |
19 |
7 |
11126 |
195.0 |
-0.6 |
0.465 |
0 |
0 |
0 |
0.000 |
| 5 |
5 |
|
[GOL]A:307 |
6 |
1 |
220 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
11126 |
131.0 |
0.6 |
0.622 |
7 |
0 |
0 |
0.022 |
| 6 |
6 |
|
[GOL]B:304 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
17 |
11 |
11408 |
128.3 |
-0.6 |
0.438 |
3 |
0 |
0 |
0.016 |
| 7 |
7 |
|
[GOL]A:308 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
17 |
12 |
11126 |
120.7 |
-0.4 |
0.474 |
4 |
0 |
0 |
0.019 |
| 8 |
8 |
|
[SO4]A:302 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
11126 |
104.4 |
-15.8 |
0.680 |
4 |
0 |
0 |
0.153 |
| 9 |
9 |
|
[SO4]B:301 |
5 |
1 |
184 |
f |
B |
x,y,z |
1_555 |
16 |
7 |
11408 |
102.4 |
-15.7 |
0.692 |
4 |
0 |
0 |
0.152 |
| 10 |
10 |
|
[GOL]A:305 |
6 |
1 |
221 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
11126 |
102.0 |
-0.4 |
0.464 |
2 |
0 |
0 |
0.011 |
| 11 |
11 |
|
A |
10 |
3 |
11126 |
◊ |
A |
-x+1,-y,z |
4_655 |
10 |
3 |
11126 |
89.7 |
-2.3 |
0.119 |
0 |
0 |
0 |
0.000 |
| 12 |
12 |
|
[GOL]A:306 |
6 |
1 |
218 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
11126 |
86.6 |
-0.8 |
0.400 |
0 |
0 |
0 |
0.007 |
| 13 |
13 |
|
[SO4]A:303 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
11126 |
81.2 |
-11.4 |
0.659 |
4 |
0 |
0 |
0.114 |
| 14 |
14 |
|
[SO4]A:304 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
11126 |
76.6 |
-9.3 |
0.925 |
3 |
0 |
0 |
0.093 |
| 15 |
15 |
|
[SO4]B:302 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
11408 |
75.5 |
-10.5 |
0.638 |
2 |
0 |
0 |
0.099 |
| 16 |
16 |
|
[SO4]A:301 |
5 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
11126 |
65.4 |
-9.5 |
0.495 |
2 |
0 |
0 |
0.090 |
| 17 |
17 |
|
B |
9 |
4 |
11408 |
x |
B |
x,y,z-1 |
1_554 |
9 |
4 |
11408 |
65.2 |
-0.3 |
0.480 |
1 |
0 |
0 |
0.000 |
| 18 |
18 |
|
A |
13 |
4 |
11126 |
◊ |
[GOL]A:306 |
-y+1,x-y,z-1/3 |
2_654 |
4 |
1 |
218 |
58.8 |
0.5 |
0.671 |
2 |
0 |
0 |
0.000 |
| 19 |
19 |
|
B |
5 |
3 |
11408 |
◊ |
[SO4]A:301 |
x-y,x-1,z+1/3 |
6_545 |
5 |
1 |
185 |
53.3 |
-5.9 |
0.916 |
1 |
0 |
0 |
0.055 |
| 20 |
20 |
|
[CL]A:309 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
11408 |
51.0 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.103 |
21 |
|
[CL]A:309 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
11126 |
50.6 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.103 |
| Average: |
50.8 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.103 |
| 21 |
22 |
|
[SO4]B:303 |
5 |
1 |
185 |
f |
B |
x,y,z |
1_555 |
6 |
4 |
11408 |
50.5 |
-7.0 |
0.565 |
1 |
0 |
0 |
0.065 |
| 22 |
23 |
|
B |
2 |
1 |
11408 |
x |
B |
x-y,x-1,z+1/3 |
6_545 |
4 |
2 |
11408 |
41.3 |
0.4 |
0.397 |
0 |
0 |
0 |
0.000 |
| 23 |
24 |
|
[GOL]A:305 |
3 |
1 |
221 |
f |
[SO4]A:304 |
x,y,z |
1_555 |
4 |
1 |
186 |
38.2 |
-4.3 |
0.676 |
1 |
0 |
0 |
0.041 |
| 24 |
25 |
|
B |
6 |
1 |
11408 |
◊ |
[SO4]B:303 |
x-y,x-1,z+1/3 |
6_545 |
4 |
1 |
185 |
37.5 |
-5.1 |
0.495 |
0 |
0 |
0 |
0.000 |
| 25 |
26 |
|
[GOL]B:304 |
4 |
1 |
221 |
◊ |
A |
-x+1,-y,z |
4_655 |
2 |
1 |
11126 |
35.9 |
-0.6 |
0.241 |
0 |
0 |
0 |
0.000 |
| 26 |
27 |
|
[GOL]A:308 |
4 |
1 |
221 |
f |
[GOL]A:306 |
x,y,z |
1_555 |
3 |
1 |
218 |
34.0 |
0.3 |
0.568 |
2 |
0 |
0 |
0.005 |
| 27 |
28 |
|
[GOL]A:306 |
3 |
1 |
218 |
◊ |
B |
-x+1,-y,z |
4_655 |
3 |
1 |
11408 |
33.5 |
-0.0 |
0.476 |
0 |
0 |
0 |
0.000 |
| 28 |
29 |
|
A |
5 |
2 |
11126 |
◊ |
[GOL]A:308 |
-y+1,x-y,z-1/3 |
2_654 |
5 |
1 |
221 |
30.4 |
0.7 |
0.643 |
1 |
0 |
0 |
0.000 |
| 29 |
30 |
|
B |
4 |
3 |
11408 |
◊ |
A |
x-y,x-1,z-2/3 |
6_544 |
5 |
2 |
11126 |
27.6 |
1.1 |
0.836 |
1 |
0 |
0 |
0.000 |
| 30 |
31 |
|
[GOL]B:304 |
2 |
1 |
221 |
◊ |
A |
x-y,x-1,z+1/3 |
6_545 |
2 |
1 |
11126 |
4.5 |
0.1 |
0.659 |
0 |
0 |
0 |
0.000 |
| 31 |
32 |
|
[SO4]A:301 |
1 |
1 |
185 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
11408 |
1.4 |
-0.2 |
0.691 |
0 |
0 |
0 |
0.002 |
|