Re: [ccp4bb] AW: [EXTERNAL] [ccp4bb] Problems with refinement of nucleic acid structure

2020-07-29 Thread Jon Cooper
Hello, have you tried anisotropic B-factor refinement? It is usually very good at cleaning-up the difference map. At that sort of resolution, you may still have some way to go in the refinement since the R and R-free usually go to about half of what you have, at least with proteins. Best

Re: [ccp4bb] AW: [EXTERNAL] [ccp4bb] Problems with refinement of nucleic acid structure

2020-07-29 Thread Eleanor Dodson
Sometimes ghost like this mean there is a spacegroup error - absences can be the result of the non-crystallographic translation and not be truly indicitive of the spacegroup. what is the possible spacegroup and what is the NC translation vector? Eleanor On Wed, 29 Jul 2020 at 14:13, Schreuder,

[ccp4bb] AW: [EXTERNAL] [ccp4bb] Problems with refinement of nucleic acid structure

2020-07-29 Thread Schreuder, Herman /DE
Dear Rafal, At this resolution, one sees many amino-acid side chains with alternative conformation, so it might be a good idea to test if this is also true for nucleotides. Best, Herman -Ursprüngliche Nachricht- Von: CCP4 bulletin board Im Auftrag von Rafal Dolot Gesendet: Mittwoch,