[Date Prev][Date Next][Thread Prev][Thread Next][Date Index][Thread Index]

Re: [ccp4bb]: mtz2various, CIF



***  For details on how to be removed from this list visit the  ***
***    CCP4 home page http://www.dl.ac.uk/CCP/CCP4/main.html    ***

> 
> Hello...
> 
> If I want to include HLA, HLB, HLC, HLD in the CIF  file, how do I tell
> mtz2various to do this ??
> 
> Stefan
> 

This is not implemented at present. No-one has asked before.

Not sure the best way to do this. mmCIF dictionary has items for
HL coeffs for particular derivatives:

_phasing_MIR_der_refln.HL_A_iso    etc.

but mlphare for example outputs the sum over all derivatives.
mmCIF has no item for this, nor for phase probabilities from
other sources, as far as I can see.

Martyn


-- 


**************************************************************************
*                                                                        *
*                  Dr. Martyn Winn                                       *
*                                                                        *
*      Daresbury Laboratory, Daresbury, Warrington, WA4 4AD, ENGLAND     *
*      Tel: +44 1925 603455    E-mail: m.d.winn@ccp4.ac.uk (personal)    *
*      Fax: +44 1925 603825    E-mail: ccp4@ccp4.ac.uk  (CCP4 problems)  * 
*          URL: http://www.dl.ac.uk/CCP/CCP4/martyn/martyn.html          *
**************************************************************************