Re: [ccp4bb] LSQKAB

2013-12-30 Thread Paul Emsley
On 30/12/13 04:10, Doeke Hekstra wrote: Hi All, I would like to superimpose a query chain (moving frame) from a rather large PDB file (~50 chains) to a target frame specified by a chain in a reference PDB file. echo "FIT RESIDUE CA 2 TO 63 CHAIN $CHAIN" >> lsqkab.conf echo "MATCH

Re: [ccp4bb] structural homologs as cross seeds

2013-12-30 Thread Patrick Shaw Stewart
There are many examples where "cross-seeding" with homologous proteins has worked, both in classical and recent work. You should add seed-stocks from any crystals with significant homology to your routine screening experiments in the first place. The important thing is to use *random *screens at