[ccp4bb] Post-Doctoral position in Pfizer (Groton, CT, USA)

2011-08-16 Thread Pandit, Jayvardhan
Dear All, A post-doctoral position is available in the Structural Biology and Biophysics group at Pfizer's research labs in Groton, Connecticut (USA). To apply, go to www.pfizer.com/careers and search for job ID 953543. Job Focus The successful candidate for this position will join Groton

Re: [ccp4bb] data collection

2011-08-16 Thread Jim Pflugrath
Many programs such as d*TREK (free download) can predict the actual reflns that would appear on detector given a particular experiment (crystal, spacegroup, unit cell, detector, detector position, wavelength, etc). A quick prediction shows that one will get about 3.9-fold redundancy with the rotat

[ccp4bb] postdoc_position

2011-08-16 Thread Ian Taylor
Dear all A postdoctoral position for a crystallographer/ enzymologist is available in the Division of Molecular Structure at the NIMR Medical Research Council National Institute for Medical Research Structure and mechanism of the retroviral restriction factor SAMHD1 Division of Molecular S

Re: [ccp4bb] HOLE & CHANNEL

2011-08-16 Thread Alexandre OURJOUMTSEV
Dear Dave, I afraid that this program is not maintained for many-many years “An algorithm to find channels and cavities within protein crystals (CHANNEL)”: Oleg S. Kisljuk, Galina S. Kachalova and Nadejda Ph. Lanina ; J. Mol. Graphics, 1994, vol12 knowing that the principal programming power

Re: [ccp4bb] Pyroglutamate in structure calculation

2011-08-16 Thread Justin Lecher
On 16/08/11 10:55, Martyn Winn wrote: > > Although I am sure there are people here who can help you, I guess you > are looking for the ccpn list: > http://www.jiscmail.ac.uk/lists/ccpnmr.html > > I think CcpNmr Analysis includes an interface to Aria, so I guess they > can help you. > > Cheers >

Re: [ccp4bb] Pyroglutamate in structure calculation

2011-08-16 Thread Martyn Winn
Although I am sure there are people here who can help you, I guess you are looking for the ccpn list: http://www.jiscmail.ac.uk/lists/ccpnmr.html I think CcpNmr Analysis includes an interface to Aria, so I guess they can help you. Cheers Martyn On Tue, 2011-08-16 at 10:40 +0200, Justin Lecher wr

Re: [ccp4bb] Pyroglutamate in structure calculation

2011-08-16 Thread Justin Lecher
On 16/08/11 10:40, Lecher, Justin wrote: > Hi all, > > I like to use Aria to calculate the structure of a short peptide with a > pyroglutamate at the Nterminus. The assignment through analysis was easy > using a PCA as Nterminal aminoacid in the sequence. But neither the > creation of an aria proj

[ccp4bb] Pyroglutamate in structure calculation

2011-08-16 Thread Justin Lecher
Hi all, I like to use Aria to calculate the structure of a short peptide with a pyroglutamate at the Nterminus. The assignment through analysis was easy using a PCA as Nterminal aminoacid in the sequence. But neither the creation of an aria project.xml through extendNMR nor a manual setup through

Re: [ccp4bb] data collection

2011-08-16 Thread Tim Gruene
-BEGIN PGP SIGNED MESSAGE- Hash: SHA1 Hello John, if you merge Friedel pairs, then yes, the multiplicity (the term used by scala and more accurate, if I understand correctly) may approach 4. If you do not merge Friedel pairs, the multiplicity may approach 2 but would not be greater. Tim