Hi Scott,
You can run CAD two or more times - merge the columns incrementally (i.e. 1..9
then (1..9)+10..16)
Best wishes Graeme
On 10 May 2019, at 23:57, Scott Horowitz
mailto:horow...@umich.edu>> wrote:
Hi all,
I’m trying to combine 16 datasets together using Cad, and it’s failing with the
following in the log file:
Key_Word Error, For LABIN FILE_NUMBER line:-
File_Number Given = 10 Is invalid only files 1 to 9 Allowed, Ignoring this
line -
It does that for all the datasets starting with number 10, which makes it seem
like it can only combine 9 datasets at a time. I was just wondering if that’s
something others have run into and dealt with before?
The whole of the log file is below, if you want to peruse it.
Thanks,
Scott
#CCP4I VERSION CCP4Interface 7.0.045
#CCP4I SCRIPT LOG cad
#CCP4I DATE 10 May 2019 14:54:40
#CCP4I USER 'UNKNOWN'
#CCP4I PROJECT Serena
#CCP4I JOB_ID 7
#CCP4I SCRATCH C:/ccp4temp
#CCP4I HOSTNAME DU-1KDZDH2
#CCP4I PID 17552
###
###
###
### CCP4 7.0.045: CAD version 7.0.045 : ##
###
User: Scott.Horowitz Run date: 10/ 5/2019 Run time: 14:54:41
Please reference: Collaborative Computational Project, Number 4. 2011.
"Overview of the CCP4 suite and current developments". Acta Cryst. D67, 235-242.
as well as any specific reference in the program write-up.
Data line--- title [No title given]
Data line--- monitor FULL
Data line--- labin file 1 E1 = R-free-flags(+) E2 = R-free-flags(-)
Data line--- labout file 1 E1 = R-free-flags(+) E2 = R-free-flags(-)
Data line--- ctypin file 1 E1 = I E2 = I
Data line--- labin file 2 E1 = F E2 = SIGF E3 = DANO E4 =
SIGDANO E5 = F(+) E6 = SIGF(+) E7 = F(-) E8 = SIGF(-) E9 =
ISYM E10 = IMEAN E11 = SIGIMEAN E12 = I(+) E13 = SIGI(+)
E14 = I(-) E15 = SIGI(-)
Data line--- labout file 2 E1 = F E2 = SIGF E3 = DANO E4 =
SIGDANO E5 = F(+) E6 = SIGF(+) E7 = F(-) E8 = SIGF(-) E9 =
ISYM E10 = IMEAN E11 = SIGIMEAN E12 = I(+) E13 = SIGI(+)
E14 = I(-) E15 = SIGI(-)
Data line--- ctypin file 2 E1 = F E2 = Q E3 = D E4 = Q E5 =
G E6 = L E7 = G E8 = L E9 = Y E10 = J E11 = Q E12 =
K E13 = M E14 = K E15 = M
Data line--- labin file 3 E1 = R-free-flags
Data line--- labout file 3 E1 = R-free-flags_4p5
Data line--- ctypin file 3 E1 = I
Data line--- labin file 4 E1 = F E2 = SIGF E3 = DANO E4 =
SIGDANO E5 = F(+) E6 = SIGF(+) E7 = F(-) E8 = SIGF(-) E9 =
ISYM E10 = IMEAN E11 = SIGIMEAN E12 = I(+) E13 = SIGI(+)
E14 = I(-) E15 = SIGI(-)
Data line--- labout file 4 E1 = F_4p5 E2 = SIGF_4p5 E3 = DANO_4p5
E4 = SIGDANO_4p5 E5 = F(+)_4p5 E6 = SIGF(+)_4p5 E7 = F(-)_4p5
E8 = SIGF(-)_4p5 E9 = ISYM_4p5 E10 = IMEAN_4p5 E11 = SIGIMEAN_4p5
E12 = I(+)_4p5 E13 = SIGI(+)_4p5 E14 = I(-)_4p5 E15 = SIGI(-)_4p5
Data line--- ctypin file 4 E1 = F E2 = Q E3 = D E4 = Q E5 =
G E6 = L E7 = G E8 = L E9 = Y E10 = J E11 = Q E12 =
K E13 = M E14 = K E15 = M
Data line--- labin file 5 E1 = R-free-flags
Data line--- labout file 5 E1 = R-free-flags_2p87
Data line--- ctypin file 5 E1 = I
Data line--- labin file 6 E1 = F E2 = SIGF E3 = DANO E4 =
SIGDANO E5 = F(+) E6 = SIGF(+) E7 = F(-) E8 = SIGF(-) E9 =
ISYM E10 = IMEAN E11 = SIGIMEAN E12 = I(+) E13 = SIGI(+)
E14 = I(-) E15 = SIGI(-)
Data line--- labout file 6 E1 = F_2p87 E2 = SIGF_2p87 E3 =
DANO_2p87 E4 = SIGDANO_2p87 E5 = F(+)_2p87 E6 = SIGF(+)_2p87 E7
= F(-)_2p87 E8 = SIGF(-)_2p87 E9 = ISYM_2p87 E10 = IMEAN_2p87
E11 = SIGIMEAN_2p87 E12 = I(+)_2p87 E13 = SIGI(+)_2p87 E14 =
I(-)_2p87 E15 = SIGI(-)_2p87
Data line--- ctypin file 6 E1 = F E2 = Q E3 = D E4 = Q E5 =
G E6 = L E7 = G E8 = L E9 = Y E10 = J E11 = Q E12 =
K E13 = M E14 = K E15 = M
Data line--- labin file 7 E1 = R-free-flags
Data line--- labout file 7 E1 = R-free-flags_2p75
Data line--- ctypin file 7 E1 = I
Data line--- labin file 8 E1 = F E2 = SIGF E3 = DANO E4 =
SIGDANO E5 = F(+) E6 = SIGF(+) E7 = F(-) E8 = SIGF(-) E9 =
ISYM E10 = IMEAN E11 = SIGIMEAN E12 = I(+) E13 = SIGI(+)
E14 = I(-) E15 = SIGI(-)
Data line--- labout file 8 E1 = F_2p75 E2 = SIGF_2p75 E3 =
DANO_2p75 E4 = SIGDANO_2p75 E5 = F(+)_2p75 E6 = SIGF(+)_2p75 E7
=
