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Re: [ccp4bb] DANO from PDB |
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- Protein crystallographyMain steps:- Protein purification- Crystallisation Special:- Programs for crystallography- X-ray detectors Basic tutorials:- Chemistry- Protein - Peptide - Amino Acids Xtal community:- CCP4BB |
CCP4bb navigationCCP4bb <-- 1999 <-- November 1999 <-- 30 November 1999Subject: Re: DANO from PDB From: Eleanor Dodson ccp4 {- at -} YSBL {- dot -} YORK {- dot -} AC {- dot -} UK Date: 2007-06-13 Well - the old way to estimate sigma was Sqrt(I**2 + constant_representing background) and then get Sigma_F as ~ sqrt(SigI)/(2*F ) . sftools would calculate that for you and append it to the output file.. Eleanor Eleanor Peter Adrian Meyer wrote: >> I add a fake "sigma" column for each "data" column because so many >> > programs require one. > > This is slightly tangential, but does anyone know of a good way to > generate semi-realistic sigma values for calculated/simulated data? > > The best I've been able to do is borrow from an experimental dataset of > the same protein (after scaling), but that doesn't work unless you've got > an experimental dataset corresponding to your simulated one. I also tried > a least-squares fit (following a reference I don't have in front of > me...this was a while ago), which didn't result in a good fit for our > data. > > Pete > > Pete Meyer > Fu Lab > BMCB grad student > Cornell University > > > CCP4bb navigationCCP4bb <-- 1999 <-- November 1999 <-- 30 November 1999 |
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