Re: [ccp4bb] How to evaluate Fourier transform ripples

2011-07-13 Thread James Holton
From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of > Zbyszek Otwinowski > Sent: Wednesday, July 06, 2011 1:19 PM > To: CCP4BB@JISCMAIL.AC.UK > Subject: Re: [ccp4bb] How to evaluate Fourier transform ripples > > The question about Fourier transformation ripples h

Re: [ccp4bb] How to evaluate Fourier transform ripples

2011-07-08 Thread conan仙人指路
Dear All, Thank you so much for the help and suggestions on the issue of Fourier Transform Ripples. They are really helpful. Best,ConanUniversity of California, Riverside

Re: [ccp4bb] How to evaluate Fourier transform ripples

2011-07-07 Thread Bernhard Rupp
org/wiki/Gibbs_phenomenon > > > > With best regards, > > > > Thierry > > > > Note: sent a 2nd time as it seems that it did not reach the BB the > > first > > time. Apologies if the message reaches you twice. > > > > -Origin

Re: [ccp4bb] How to evaluate Fourier transform ripples

2011-07-07 Thread Colin Nave
cularly at different resolution cut offs. > -Original Message- > From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of > Fischmann, Thierry > Sent: 06 July 2011 18:59 > To: CCP4BB@JISCMAIL.AC.UK > Subject: Re: [ccp4bb] How to evaluate Fourier transform r

Re: [ccp4bb] How to evaluate Fourier transform ripples

2011-07-06 Thread Nicholas M Glykos
Hi Conan, > Specifically, the reviewers question whether ripples may affect on the > electron density around heavy metal center which has a Mo-S-As > connection. From which angle or in which way this problem should be > addressed most convincingly ? The maximum entropy estimate of the map shou

Re: [ccp4bb] How to evaluate Fourier transform ripples

2011-07-06 Thread Fischmann, Thierry
011 1:19 PM To: CCP4BB@JISCMAIL.AC.UK Subject: Re: [ccp4bb] How to evaluate Fourier transform ripples The question about Fourier transformation ripples has a straightforward answer in a fairly typical situation: A) data are collected to the resolution limit of diffraction, B) phases are unifo

Re: [ccp4bb] How to evaluate Fourier transform ripples

2011-07-06 Thread Zbyszek Otwinowski
The question about Fourier transformation ripples has a straightforward answer in a fairly typical situation: A) data are collected to the resolution limit of diffraction, B) phases are uniform in quality across the resolution range, which is equivalent to R-free being uniform with respect to resol

Re: [ccp4bb] How to evaluate Fourier transform ripples

2011-07-06 Thread Jim Pflugrath
I would be very careful about any bond to As. I would imagine such bonds would be very susceptible to radiolysis with typical radiation used in the diffraction data collection. Have you performed some diffraction experiments of various time lengths (or flux) and seen what happens around this

Re: [ccp4bb] How to evaluate Fourier transform ripples

2011-07-06 Thread David Schuller
I note that all three of those atoms should have anomalous scattering and should show up as peaks in anomalous Fourier maps if you collected data carefully enough at multiple wavelengths. The As K edge is 1.04 A, which is easily within reach of most MAD synchrotron beamlines. The Mo peaks are out o

[ccp4bb] How to evaluate Fourier transform ripples

2011-07-06 Thread conan仙人指路
Dear All, Hi. I was asked in a manuscript revision to discuss about the possible effects of Fourier transformation ripples on the crystallographic results. Specifically, the reviewers question whether ripples may affect on the electron density around heavy metal center which has a Mo-S-