Re: [ccp4bb] AW: complex multi-crystal averaging

2019-01-09 Thread Eleanor Dodson
Hmm - You say you have the Se positions in the P3121 form, plus some roughly placed helices, so you should be able to get the matrices which interconvert the three P3121 molecules. (there are superpose coordinate programs. GESANt or LSQKAB, which will give these..) and PHASER output gives you the

[ccp4bb] AW: complex multi-crystal averaging

2019-01-09 Thread Herman . Schreuder
Dear Andy, Best would be to convert the phaser angles (plus vector) in a matrix (plus vector) and use this for your transformations. The phaser people should be able to provide you with information how to do this, since they have to do it in order to produce their output files. Alternatively, y