Re: [ccp4bb] Fwd: [ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21

2013-10-03 Thread Dom Bellini
horombic lattice. D From: CCP4 bulletin board [CCP4BB@JISCMAIL.AC.UK] on behalf of Dom Bellini [dom.bell...@diamond.ac.uk] Sent: 03 October 2013 08:21 To: ccp4bb Subject: Re: [ccp4bb] Fwd: [ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21 QUICK ERRATUM Sorry W, I forgot a v

Re: [ccp4bb] Fwd: [ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21

2013-10-03 Thread Dom Bellini
: CCP4 bulletin board [CCP4BB@JISCMAIL.AC.UK] on behalf of Ethan A Merritt [merr...@u.washington.edu] Sent: 03 October 2013 00:53 To: ccp4bb Subject: Re: [ccp4bb] Fwd: [ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21 On Wednesday, 02 October, 2013 17:31:06 wtempel wrote: > Tim,

Re: [ccp4bb] Fwd: [ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21

2013-10-02 Thread Ethan A Merritt
sage ------ > From: Tim Gruene > Date: Wed, Oct 2, 2013 at 4:13 PM > Subject: Re: [ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21 > To: wtempel > Cc: CCP4BB@jiscmail.ac.uk > > > Dear W., > > if P21 is a proper subgroup of C2221, scaling a P21 data se

Re: [ccp4bb] Fwd: [ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21

2013-10-02 Thread Dom Bellini
do this. HTH D From: CCP4 bulletin board [CCP4BB@JISCMAIL.AC.UK] on behalf of wtempel [wtem...@gmail.com] Sent: 02 October 2013 22:31 To: ccp4bb Subject: [ccp4bb] Fwd: [ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21 Tim, I agree with your

[ccp4bb] Fwd: [ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21

2013-10-02 Thread wtempel
P21 with properly transfered free flags. I just do not know how to accomplish that transfer. W. -- Forwarded message -- From: Tim Gruene Date: Wed, Oct 2, 2013 at 4:13 PM Subject: Re: [ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21 To: wtempel Cc: CCP4BB@jiscmail.ac.uk -

Re: [ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21

2013-10-02 Thread Tim Gruene
the other half of the data set or even if something is > wrong at this point already. W. > > -- Forwarded message ------ From: Appu kumar > Date: Wed, Oct 2, 2013 at 1:29 PM Subject: > Re: [ccp4bb] expanding reflections from C2221 to P21 To: wtempel > , CCP4BB

[ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21

2013-10-02 Thread wtempel
-- From: Appu kumar Date: Wed, Oct 2, 2013 at 1:29 PM Subject: Re: [ccp4bb] expanding reflections from C2221 to P21 To: wtempel , CCP4BB How do you suspect that C2221 is 'pseudo' and P21 is 'real'? You can use the reindex programme incorporated in ccp4 suit. Reindex programme

[ccp4bb] השב: Re: [ccp4bb] expanding reflections from C2221 to P21

2013-10-02 Thread Boaz Shaanan
-- הודעה מקורית מאת "Randy J. Read" תאריך: 02/10/2013 20:07 (GMT+02:00) אל CCP4BB@JISCMAIL.AC.UK נושא Re: [ccp4bb] expanding reflections from C2221 to P21 I suspect the problem is that sftools hasn't been modernised to alter all the cell dimension records used in curre

[ccp4bb] Fwd: [ccp4bb] expanding reflections from C2221 to P21

2013-10-02 Thread wtempel
. -- Forwarded message -- From: Randy J. Read Date: Wed, Oct 2, 2013 at 1:07 PM Subject: Re: [ccp4bb] expanding reflections from C2221 to P21 To: wtempel Cc: "CCP4BB@JISCMAIL.AC.UK" I suspect the problem is that sftools hasn't been modernised to alter all the cell di

Re: [ccp4bb] expanding reflections from C2221 to P21

2013-10-02 Thread Appu kumar
How do you suspect that C2221 is 'pseudo' and P21 is 'real'? You can use the reindex programme incorporated in ccp4 suit. Reindex programme can expand symmetry from C2221 to P21.I Hope you will get the result. Thank you Appu On 2 October 2013 21:43, wtempel wrote: > Hello, > I would like to exp

Re: [ccp4bb] expanding reflections from C2221 to P21

2013-10-02 Thread Randy J. Read
I suspect the problem is that sftools hasn't been modernised to alter all the cell dimension records used in current MTZ files. I can't remember right now but maybe the DCELL command in cad might fix it. Randy Read Randy J. Read > On 2 Oct 2013, at 17:13, wtempel wrote: > > Hello, > I

[ccp4bb] expanding reflections from C2221 to P21

2013-10-02 Thread wtempel
Hello, I would like to expand a reflection data set in mtz format from C2221 to P21. The purpose is to obtain consistent R-free flags based on a structure already refined in C2221 for a related data set that I suspect is pseudo-C2221 but "real" P21. Primitive cell dimensions are: 37.6 126.1 40.61