Dear Pavel: Thanks a lot! I will try phenix.refine!
Best Regards, Hailaing > Hi Hailiang, > > you didn't specify which program you are using... > > For example, you can do it in phenix.refine: > > phenix.refine model.pdb data.mtz strategy=individual_adp > adp.individual.iso="chain A and resseq 123" > > which will refine isotropic ADPs for residue number 123 in chain A only, > or > > phenix.refine model.pdb data.mtz strategy=individual_adp > adp.individual.aniso="chain A and resseq 123" > > which will refine anisotropic ADPs for residue number 123 in chain A only. > > You can do it in Shelxl too. Don't know about other programs. > > Pavel. > > On 8/15/10 10:35 AM, Hailiang Zhang wrote: >> Hi there: >> >> For a PDB with B values refined, if I modify/addto its local structure >> (mutation, add 1 residue...), is there any way I can refine the B values >> only for the modified/added structure while keeping already refined B >> values unchanged? >> >> Thanks! >> >> Best Regards, Hailiang > > >
