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ccp4i

Reflection Data Utilities

Convert to/modify/extend MTZ

Input reflection file is in XPLOR/CNS format etc

Fortran format (7X,3I5,6X,E12.4,7X,E12.4,6X,I2) Skip first 6 lines (if 
######### is part of the .cv file)

[I think, I have counted the space before the INDEx for example giving 
me 7X; basically it's a question of counting the characters in the INDEx 
records]

HTH,

Fred.

Marni Williams wrote:
>
> Hey
>  
> I have a problem with converting a CNS created file in .cv format to 
> .mtz for use in CCP4. I suspect it is because the Fortran model and 
> the column labels are incorrect but I have no idea how to fix this. 
> Here are the first few lines of the .cv <http://the.cv> file:
>  
> ###############################################################
> NREFlection=       98435
>   ANOMalous=FALSe
>   DECLare NAME=FOBS  DOMAin=RECIprocal   TYPE=REAL END
>   DECLare NAME=SIGMA DOMAin=RECIprocal   TYPE=REAL END
>   DECLare NAME=TEST  DOMAin=RECIprocal   TYPE=INTE END
>  INDEx    0    0    2 FOBS=  0.2276E+02 SIGMA=  0.1094E+02 TEST= 0
>  INDEx    0    0    3 FOBS=  0.8401E+03 SIGMA=  0.9090E+01 TEST= 0
>  INDEx    0    0    4 FOBS=  0.1032E+04 SIGMA=  0.1418E+02 TEST= 0
> ##############################################################
>
> any advice would be greatly appreciated.
>  
> Regards,
> Marni Williams
>
>
> -- 
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