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1RQW: Difference between revisions
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==Thaumatin structure solution from either 2-wavelength MAD, or from | ==Thaumatin Br soak: structure solution from either 2-wavelength MAD, or from single wavelength SAD== | ||
Prior to flash cooling in liquid nitrogen at 100 K the crystals were soaked for a few seconds in a solution containing 1 M sodium bromide and 25% (v/v) glycerol. | |||
The peak and inflection datasets (360 images each) are available from the [http://www.embl-hamburg.de EMBL Hamburg] website. The XDS data reductions are [ftp://turn5.biologie.uni-konstanz.de//pub/xds-datared/1rqw here]. | The peak and inflection datasets (360 images each) are available from the [http://www.embl-hamburg.de EMBL Hamburg] website. The XDS data reductions are [ftp://turn5.biologie.uni-konstanz.de//pub/xds-datared/1rqw here]. | ||
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=== automatic structure solution using Auto-Rickshaw === | === automatic structure solution using Auto-Rickshaw === | ||
DPS2AR.csh datafile1 thau-peak-I.mtz keeps world ver completeversion nres 207 nsm 20 masu 1 meth SAD SG P41212 email kay.diederichs@uni-konstanz.de sequencefile 1rqw.seq | |||
This uses Santosh Panjikar's script DPS2AR.csh: | |||
DPS2AR.csh datafile1 thau-peak-I.mtz keeps world ver completeversion nres 207 nsm 20 masu 1 meth SAD SG P41212 \ | |||
email kay.diederichs@uni-konstanz.de sequencefile 1rqw.seq | |||
where 1rqw.seq is | where 1rqw.seq is | ||