| ## |
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 |
|
A |
63 |
18 |
8259 |
x |
A |
x-y+1,x+1,z+1/6 |
6_665 |
65 |
18 |
8259 |
628.7 |
-3.7 |
0.670 |
5 |
2 |
0 |
0.000 |
2 |
|
[HEC]A:202 |
43 |
1 |
822 |
cf |
A |
x,y,z |
1_555 |
76 |
24 |
8259 |
573.8 |
-22.7 |
0.341 |
2 |
0 |
0 |
0.019 |
3 |
|
[HEC]A:204 |
43 |
1 |
806 |
cf |
A |
x,y,z |
1_555 |
66 |
24 |
8259 |
553.4 |
-21.3 |
0.408 |
5 |
0 |
0 |
0.019 |
4 |
|
[HEC]A:201 |
43 |
1 |
807 |
cf |
A |
x,y,z |
1_555 |
69 |
25 |
8259 |
537.6 |
-21.8 |
0.227 |
1 |
0 |
0 |
0.018 |
5 |
|
[HEC]A:203 |
43 |
1 |
838 |
cf |
A |
x,y,z |
1_555 |
58 |
23 |
8259 |
494.0 |
-19.4 |
0.102 |
1 |
0 |
0 |
0.016 |
6 |
|
A |
27 |
9 |
8259 |
◊ |
A |
x,x-y+2,-z+1/6 |
12_575 |
27 |
9 |
8259 |
285.2 |
-4.9 |
0.343 |
0 |
0 |
0 |
0.000 |
7 |
|
A |
26 |
7 |
8259 |
◊ |
A |
x,x-y+1,-z+1/6 |
12_565 |
26 |
7 |
8259 |
225.8 |
0.3 |
0.793 |
2 |
0 |
0 |
0.000 |
8 |
|
A |
18 |
5 |
8259 |
◊ |
A |
-x+y,y,-z+1/2 |
11_555 |
19 |
5 |
8259 |
192.2 |
-1.8 |
0.562 |
2 |
0 |
0 |
0.000 |
9 |
|
A |
13 |
7 |
8259 |
x |
A |
y-1,x,-z+1/3 |
7_455 |
15 |
6 |
8259 |
120.0 |
-2.3 |
0.398 |
0 |
0 |
0 |
0.000 |
10 |
|
[HEC]A:203 |
10 |
1 |
838 |
◊ |
A |
x-y+1,x+1,z+1/6 |
6_665 |
18 |
5 |
8259 |
117.5 |
-3.8 |
0.577 |
0 |
0 |
0 |
0.000 |
11 |
|
[SO4]A:300 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
8259 |
103.5 |
-17.1 |
0.675 |
3 |
0 |
0 |
0.015 |
12 |
|
A |
12 |
4 |
8259 |
◊ |
A |
-x,-x+y,-z+2/3 |
9_555 |
12 |
4 |
8259 |
95.3 |
-2.7 |
0.323 |
0 |
0 |
0 |
0.000 |
13 |
|
[HEC]A:203 |
15 |
1 |
838 |
f |
[HEC]A:201 |
x,y,z |
1_555 |
4 |
1 |
807 |
69.8 |
-2.3 |
0.734 |
0 |
0 |
0 |
0.002 |
14 |
|
[HEC]A:204 |
4 |
1 |
806 |
f |
[HEC]A:203 |
x,y,z |
1_555 |
13 |
1 |
838 |
63.7 |
-1.9 |
0.798 |
0 |
0 |
0 |
0.002 |
15 |
|
[SO4]A:301 |
5 |
1 |
189 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
8259 |
63.3 |
-9.4 |
0.802 |
1 |
0 |
0 |
0.008 |
16 |
|
A |
8 |
2 |
8259 |
◊ |
[HEC]A:203 |
x-y+1,x+1,z+1/6 |
6_665 |
4 |
1 |
838 |
51.4 |
-1.9 |
0.490 |
0 |
0 |
0 |
0.000 |
17 |
|
[HEC]A:202 |
3 |
1 |
822 |
f |
[HEC]A:201 |
x,y,z |
1_555 |
11 |
1 |
807 |
49.7 |
-1.7 |
0.764 |
0 |
0 |
0 |
0.001 |
18 |
|
[HEC]A:204 |
5 |
1 |
806 |
◊ |
A |
y-1,x,-z+1/3 |
7_455 |
8 |
2 |
8259 |
49.5 |
-1.3 |
0.679 |
0 |
0 |
0 |
0.000 |
19 |
|
A |
3 |
2 |
8259 |
◊ |
[SO4]A:301 |
x-y+1,x+1,z+1/6 |
6_665 |
4 |
1 |
189 |
41.7 |
-3.9 |
0.939 |
1 |
0 |
0 |
0.000 |
20 |
|
A |
5 |
2 |
8259 |
◊ |
A |
y-1,x+1,-z+1/3 |
7_465 |
5 |
2 |
8259 |
41.2 |
0.7 |
0.811 |
0 |
0 |
0 |
0.000 |
21 |
|
[HEC]A:201 |
2 |
1 |
807 |
◊ |
A |
x,x-y+2,-z+1/6 |
12_575 |
7 |
4 |
8259 |
41.1 |
-0.9 |
0.509 |
0 |
0 |
0 |
0.000 |
22 |
|
[HEC]A:202 |
3 |
1 |
822 |
◊ |
A |
-x+y,y,-z+1/2 |
11_555 |
5 |
1 |
8259 |
40.1 |
-2.2 |
0.381 |
0 |
0 |
0 |
0.000 |
23 |
|
A |
5 |
2 |
8259 |
◊ |
A |
-x+y-1,y,-z+1/2 |
11_455 |
5 |
2 |
8259 |
33.5 |
0.5 |
0.788 |
0 |
0 |
0 |
0.000 |
24 |
|
A |
5 |
2 |
8259 |
◊ |
[SO4]A:300 |
x-y+1,x+1,z+1/6 |
6_665 |
4 |
1 |
189 |
31.6 |
-3.7 |
0.869 |
1 |
0 |
0 |
0.000 |
25 |
|
[SO4]A:301 |
4 |
1 |
189 |
◊ |
A |
y-1,x,-z+1/3 |
7_455 |
2 |
1 |
8259 |
22.4 |
-2.4 |
0.680 |
0 |
0 |
0 |
0.000 |
26 |
|
A |
2 |
1 |
8259 |
◊ |
[HEC]A:201 |
x-y+1,x+1,z+1/6 |
6_665 |
3 |
1 |
807 |
19.6 |
0.0 |
0.854 |
0 |
0 |
0 |
0.000 |
27 |
|
[HEC]A:203 |
2 |
1 |
838 |
f |
[HEC]A:202 |
x,y,z |
1_555 |
2 |
1 |
822 |
18.5 |
-0.6 |
0.685 |
0 |
0 |
0 |
0.000 |
28 |
|
A |
3 |
2 |
8259 |
◊ |
[HEC]A:202 |
y-1,x,-z+1/3 |
7_455 |
4 |
1 |
822 |
16.7 |
-0.3 |
0.796 |
0 |
0 |
0 |
0.000 |
29 |
|
[HEC]A:203 |
1 |
1 |
838 |
◊ |
[SO4]A:300 |
x-y+1,x+1,z+1/6 |
6_665 |
1 |
1 |
189 |
7.1 |
-1.3 |
0.452 |
0 |
0 |
0 |
0.000 |
30 |
|
[HEC]A:203 |
1 |
1 |
838 |
◊ |
A |
-x+y-1,y,-z+1/2 |
11_455 |
1 |
1 |
8259 |
1.4 |
-0.1 |
0.665 |
0 |
0 |
0 |
0.000 |
|