Re: [ccp4bb]: Molecular replacement in C2/I222

[Anastassis Perrakis]

In the danger of sounding a bit boring, should you decide for this alternative, if the correct solution is there, at 1.75 A it must be bread and butter for ARP/wARP. I would even suggest to bypass the gui and use  auto_warp.sh with some minor scripting around it, you can get it to test all your PDB files in a raw. A. Usage: auto_warp.sh workdir {FULL_PATH_WORKING_DIRECTORY} datafile {FULL_PATH/mtzfile} nresidues {number of residues in  the asymmetric unit} [ncs {copies of the molecule in the asymmetric unit}] [seqin {FULL_PATH/sequence file] [modelin {FULL_PATH/starting PDB file}] [fp {fp label}] [sigfp {sigfp label}] [phibest {best phi label}] [fom {figure of merit label}] [freer {label for freer reflections}] [bigcycles {building cycles}] [arpcycles {arp refinement cycles between building}] On Apr 4, 2006, at 16:37, Artem Evdokimov wrote: 2. Automatically refine all of the top 30-40 solutions because chances are that one of them is probably ok.