Hi all- I am trying to merge 3 Scalepack .sca files into 1 MTZ file using Aimless in CCP4i (CCP4 version 6.4.0). However, Aimless fails with the error that it does not recognize my rhombohedral space group (R32).
#CCP4I TERMINATION STATUS 0 "Spgr_descr: No such HM symbol" I'm used to this as in the past when coming from HKL2000, I have substituted H for R when running certain programs in CCP4. But even if I edit my .sca files to replace H with R, it fails with the same error. Also, it fails if I have a space between h and 3. Here is the top few lines of one of my .sca files (I edited to substitute h for r and put a space between h and 3): 6 h 32 1 0 0 0 1 0 0 0 1 0 0 0 0 -1 0 1 -1 0 0 0 1 0 0 0 -1 1 0 -1 0 0 0 0 1 0 0 0 0 1 0 1 0 0 0 0 -1 0 0 0 -1 0 0 -1 1 0 0 0 -1 0 0 0 1 -1 0 0 -1 0 0 0 -1 0 0 0 0 0 12 0 0 12 1 0 0 1 5102.6 319.8 0 0 15 0 0 15 2 0 0 1 196.4 16.4 0 0 18 0 0 18 3 0 0 1 179.8 13.8 0 0 21 0 0 21 3 0 0 1 2687.3 143.0 0 0 24 0 0 24 4 0 0 1 1272.8 63.4 0 0 27 0 0 27 5 0 0 1 810.6 42.5 0 0 36 0 0 36 7 0 0 1 7.9 20.6 0 0 39 0 0 39 8 0 0 1 43.5 21.1 0 1 41 1 0 -41 8 0 0 4 92.7 24.3 -1 0 41 1 0 -41 7 0 0 5 84.2 29.0 1 -1 41 1 0 -41 10 0 0 6 161.9 31.2 Any workaround here? Thanks- Brad