ProcessStationA.txt

[example of input for processing data with denzo]

format mar345 345mm 150 marpck
overload value 64999error density 1.75
profile fitting radius 30.0

vertical axis 0 0 1
spindle axis 0 1 0
wavelength 0.80027lattice C monocliniccell 21.214 5.928 15.164 90.000 117.160 90.000
crystal rotx 140.985 roty -2.862 rotz 124.466
detector rotx -0.09 roty -0.06 rotz 0.00
distance 100.00
x beam 173.446 y beam 172.916
film rotation 90.000
radial offset 0.045 angular offset 0.013
crossfire y -0.015 x -0.009 xy -0.012

mosaicity 0.5
resolution limits 15.0 0.8

box 2.4 2.4
spot elliptical 0.5 0.5 0.0
background elliptical 0.6 0.6 0.0
overlap spot

title 'Ge-serine20102_120K'
raw data file 'test_###.mar2300'
film output file 'test_###.mar2300.x'

oscillation start 0
oscillation range 2.0 sector 1 to 137fix all

start refinement
print no shifts no profiles
resolution limits 15.0 0.8
fit crystal rotx roty rotz
go go go

fit cassette rotx roty
fit distance cell x beam y beam crossfire x y xy
go go go go
fix cell
fit radial offset angular offset
go go go go go
print profiles 1 1

write predictions
calculate go

end of pack