[ccp4bb] Aw: [ccp4bb] AW: [EXTERNAL] [ccp4bb] refmac5 problems with unnatural amino acid

2019-04-05 Thread Deniz Üresin
Hello, thanks for your reply! I already checked and couldn't find my residue anywhere in the library. With kind regards, Deniz -- Diese Nachricht wurde von meinem Android Mobiltelefon mit WEB.DE Mail gesendet.Am 03.04.19, 17:08, herman.schreu...@sanofi.com schrieb: Dear Deniz,   In the past,

Re: [ccp4bb] AW: [EXTERNAL] [ccp4bb] refmac5 problems with unnatural amino acid

2019-04-03 Thread Eleanor Dodson
Usually externaly provided has pecedent over library routine .. you need to label any "amino-acid" as a peptide though to generate the required links in the protein chain. E On Wed, 3 Apr 2019 at 16:09, wrote: > Dear Deniz, > > > > In the past, I had similar problems caused by the fact that

[ccp4bb] AW: [EXTERNAL] [ccp4bb] refmac5 problems with unnatural amino acid

2019-04-03 Thread Herman . Schreuder
Dear Deniz, In the past, I had similar problems caused by the fact that when the residue was “known” to ccp4, it would use the cif file from the ccp4 library instead of the cif I had created myself. You could check if this might be the case for you. You find the cif files under