Re: [ccp4bb] "Finding Chlorine" =)

2007-11-29 Thread Sabini, Elisabetta
indication that the binding pose has >> moved due to cleavage. That is the case for my compounds. >> >> Good luck! >> Thierry >> >> >> -Original Message- >> From: CCP4 bulletin board [mailto:[EMAIL PROTECTED] On Behalf Of >> Sabini, Elisab

Re: [ccp4bb] "Finding Chlorine" =)

2007-11-29 Thread Garib Murshudov
e! It is a known REFMAC issue. Tadeusz "Sabini, Elisabetta" <[EMAIL PROTECTED]> Sent by: "CCP4 bulletin board" 29-Nov-2007 21:40 Please respond to "Sabini, Elisabetta" <[EMAIL PROTECTED]> To CCP4BB@JISCMAIL.AC.UK cc Subject [ccp4bb] "Finding Chlor

Re: [ccp4bb] "Finding Chlorine" =)

2007-11-29 Thread Tadeusz Skarzynski
. Tadeusz "Sabini, Elisabetta" <[EMAIL PROTECTED]> Sent by: "CCP4 bulletin board" 29-Nov-2007 21:40 Please respond to "Sabini, Elisabetta" <[EMAIL PROTECTED]> To CCP4BB@JISCMAIL.AC.UK cc Subject [ccp4bb] "Finding Chlorine" =) Dear all, I

Re: [ccp4bb] "Finding Chlorine" =)

2007-11-29 Thread Sabini, Elisabetta
dn't show the Cl for #2, but I > would show it for #1 if there is no indication that the binding pose has > moved due to cleavage. That is the case for my compounds. > > Good luck! > Thierry > > > -Original Message- > From: CCP4 bulletin board [mailto:[EMAIL P

[ccp4bb] "Finding Chlorine" =)

2007-11-29 Thread Sabini, Elisabetta
Dear all, I am refining two structures which have in the active site a ligand containing a covalent bond between a carbon and a chlorine atom. I collected the data at APS, SERCAT ID-22. Because of radiation damage I tried different occupancy values for the chlorine atom and structure number #1 i