Hi,
You also can try the MR program Queen of Spades (Qs) (
http://utopia.duth.gr/~glykos/Qs.html; documentation,
http://utopia.duth.gr/~glykos/pdf/Qs.pdf). It is a multi-dimensional MR, so
it will use a lot of CPU time and memory, but might be worth try it.
Good luck.
Andrey Nascimento
2013/4/18
sfcheck
analysis to both space groups.
Thank you very much.
Andrey
2013/3/28 Andrey Nascimento
>
>> Dear Appu,
>> I am sorry, I do not have the script file. I ran it basically from
>> default parameters in CCP4 GUI. I just ran the sfcheck for 'check
>> experimental data
win on mtz file but it getting failed. Could you please tell me how
> you did this. If possible send me your script file. It will be a great help
> for me.
> Thank you in advance.
> Appu
>
> On 28 March 2013 05:10, Andrey Nascimento wrote:
>
>> Dear all,
>>
>>
&
I am agree with Tassos. For me it is a quite stranger to think about hide
the data to nobody see until the paper be published. In my opinion, a lot
of data become obsolete (or even forgotten) because that "one more"
experiment you need to publish a "great" paper (it some times takes
years...). For
nt
> with the pointgroup, or try to work out how to position your P22121
> solution in the new SG. There may well be 2n+1 copies of your molecule
> when you double the size of the asymmetric unit - all hard to check
> without more information.
> Good luck Eleanor
>
>
>
>
;> in
> >> ASU), Rfactor/Rfree drops to 0.20978/0.25719 in the first round
> >> of refinement (without put waters, ligands, etc.).
> >>
> >> Indeed, there were one more molecule in ASU, but the over-merged data in
> >> an orthorhombic lattice hid the co
molecule in ASU, but the over-merged data in
an orthorhombic lattice hid the correct solution.
Thank you very much for all your suggestions, they were very important to
solve this problem.
Cheers,
Andrey
2013/3/15 Andrey Nascimento
> *Dear all,*
>
> *I have collected a good quality d
*Dear all,*
*I have collected a good quality dataset of a protein with 64% of solvent
in P 2 21 21 space group at 1.7A resolution with good statistical
parameters (values for last shell: Rmerge=0.202; I/Isig.=4.4; Complet.=93%
Redun.=2.4, the overall values are better than last shell). The structu
