[ccp4bb] POSTDOCTORAL FELLOWSHIP POSITION

2020-05-01 Thread Francis Tsai
A POSTDOCTORAL FELLOWSHIP position is available in the group of Prof. Francis Tsai at Baylor College of Medicine in Houston, TX. The Tsai lab uses X-ray crystallography and single-particle cryoEM to determine 3D structures of protein machines to provide new structural and mechanistic insights (P

Re: [ccp4bb] Ligand Refinement in coot

2020-05-01 Thread Eleanor Dodson
If you have a smiles string or some representation of your ligand ACEDRG will make sensible restraints. Ekeanor On Fri, 1 May 2020 at 10:50, Barone, Matthias wrote: > do you mean earlier whne coot was connected to phenix during the > refinement? If you load the pdb and the mtz directly into coot

Re: [ccp4bb] Ligand Refinement in coot

2020-05-01 Thread Barone, Matthias
do you mean earlier whne coot was connected to phenix during the refinement? If you load the pdb and the mtz directly into coot, you have to load the cif file beofre starting the real space refinement in coot. Dr. Matthias Barone AG Kuehne, Rational Drug Design Leibniz-Forschungsinstitut für