Re: [ccp4bb] Off-topic - Crystallisation in anaerobic glove box

2015-03-18 Thread Edward A. Berry

Do you have evidence that the oil blocks diffusion of O2? O2 is a nonpolar 
molecule, generally much more soluble in oils than in water. I'm not sure about 
silicone oils, but I would think they also dissolve O2 readily.
eab

On 03/18/2015 08:02 AM, Patrick Shaw Stewart wrote:


Hi Steve

I have one more comment for this thread.

The microbatch-under-oil method is very handy for anaerobic work:

1.  You can keep the microbatch stock solutions in normal microtitre plates 
(polypropylene is best to reduce evaporation) for months, which hugely reduces 
the amount of degassing that you need to do.  You will only use say 0.5 ul of 
stock per drop.

2.  The oil offers a surprising amount of protection from oxidation, which 
may be helpful eg in harvesting.

3.  Microbatch can be automated - in parallel to vapor diffusion if desired


It's amazing how often (aerobic) microbatch produces far superior crystals to 
V.D. for no obvious reason - it's well worth trying for both screening and 
optimization.

Best wishes

Patrick



On 11 March 2015 at 10:17, Stephen Carr stephen.c...@rc-harwell.ac.uk 
mailto:stephen.c...@rc-harwell.ac.uk wrote:

Dear CCP4BBer's

Apologies for the off-topic post, but the CCP4BB seems to be the best place 
to ask about crystallisation.

I am looking to set up crystallisation in an anaerobic glove box and 
wondered how other people did this, specifically the crystallisation stage.  My 
initial thoughts were to place a small crystallisation incubator inside the 
box, however the smallest I have come across so far (~27L) is still rather 
large.  Has anyone come across smaller incubators?  Alternatively are 
incubators even neccessary if the glove box is placed in a room with good air 
conditioning and stable temperature control?

Any recommendations would be very helpful.

Thanks in advance,

Steve Carr

Dr Stephen Carr
Research Complex at Harwell (RCaH)
Rutherford Appleton Laboratory
Harwell Oxford
Didcot
Oxon OX11 0FA
United Kingdom
Email stephen.c...@rc-harwell.ac.uk mailto:stephen.c...@rc-harwell.ac.uk
tel 01235 567717 tel:01235%20567717

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  Directors: Peter Baldock, Patrick Shaw Stewart

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  Regd. England 2177994, VAT Reg. GB 480 7371 36


Re: [ccp4bb] Off-topic - Crystallisation in anaerobic glove box

2015-03-18 Thread Patrick Shaw Stewart
Hi Steve

I have one more comment for this thread.

The microbatch-under-oil method is very handy for anaerobic work:

1.  You can keep the microbatch stock solutions in normal microtitre plates
(polypropylene is best to reduce evaporation) for months, which hugely
reduces the amount of degassing that you need to do.  You will only use say
0.5 ul of stock per drop.

2.  The oil offers a surprising amount of protection from oxidation, which
may be helpful eg in harvesting.

3.  Microbatch can be automated - in parallel to vapor diffusion if desired


It's amazing how often (aerobic) microbatch produces far superior crystals
to V.D. for no obvious reason - it's well worth trying for both screening
and optimization.

Best wishes

Patrick




On 11 March 2015 at 10:17, Stephen Carr stephen.c...@rc-harwell.ac.uk
wrote:

 Dear CCP4BBer's

 Apologies for the off-topic post, but the CCP4BB seems to be the best
 place to ask about crystallisation.

 I am looking to set up crystallisation in an anaerobic glove box and
 wondered how other people did this, specifically the crystallisation
 stage.  My initial thoughts were to place a small crystallisation incubator
 inside the box, however the smallest I have come across so far (~27L) is
 still rather large.  Has anyone come across smaller incubators?
 Alternatively are incubators even neccessary if the glove box is placed in
 a room with good air conditioning and stable temperature control?

 Any recommendations would be very helpful.

 Thanks in advance,

 Steve Carr

 Dr Stephen Carr
 Research Complex at Harwell (RCaH)
 Rutherford Appleton Laboratory
 Harwell Oxford
 Didcot
 Oxon OX11 0FA
 United Kingdom
 Email stephen.c...@rc-harwell.ac.uk
 tel 01235 567717

 This email and any attachments may contain confidential, copyright and or
 privileged material, and are for the use of the intended addressee only. If
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 patr...@douglas.co.ukDouglas Instruments Ltd.
 Douglas House, East Garston, Hungerford, Berkshire, RG17 7HD, UK
 Directors: Peter Baldock, Patrick Shaw Stewart

 http://www.douglas.co.uk
 Tel: 44 (0) 148-864-9090US toll-free 1-877-225-2034
 Regd. England 2177994, VAT Reg. GB 480 7371 36


Re: [ccp4bb] OS X yosemite

2015-03-18 Thread Xiao Lei
Hi Mirek,

I have to reinstall xquartz to get my ccp4 and coot working after upgrading
to Yosemite from Mavericks.

Xiao

On Tue, Mar 17, 2015 at 4:30 PM, Cygler, Miroslaw miroslaw.cyg...@usask.ca
wrote:

  Hi,
 I am thinking of upgrading the os on my mac to Yosemite. Are there any
 known issues for crystallographic software that I should pay attention to?
 Thanks,

 Mirek






[ccp4bb] PhD position in Durham

2015-03-18 Thread POHL E.
Project description
Herbicide resistance of weeds is a major challenge for global food production. 
The situation becomes particularly severe when weeds become resistant to 
multiple modes of herbicide action (multiple herbicide resistance=MHR). This 
collaborative project between Durham University and Syngenta aims to unravel 
the molecular mechanisms of MHR in black grass, a major weed in cereal crops in 
the UK and beyond. In recent work we have demonstrated that MHR in black grass 
is associated with the up-regulation of one particular 
glutathione-S-transferase (GSTF1), and furthermore, that the observed 
resistance can be reversed by certain chemical compounds. However, the 
molecular basis for these observations remains to be established and represents 
the key goal of this project. The research will involve the characterization of 
GSTF1-ligand interactions using a combination of biophysical (including thermal 
shift assay, surface plasmon resonance, isothermal titration calorimetry) 
computational and crystallographic methods. The insight gained will then be 
used to elucidate how the enzyme achieves multiple herbicide resistance and to 
design and synthesize new herbicide synergists. Ultimately we seek to apply 
these finding to explore to orthologous enzymes identified in other important 
cereal weeds including rye grass and wild oat which also display an MHR 
phenotype.

Funding and how to apply
This project is fully funded CASE with Syngenta. Success will depend on the 
quality of applications received. If you are interested in applying, in the 
first instance contact Ehmke (ehmke.p...@durham.ac.uk), with a CV and covering 
letter, detailing your reasons for applying for the project.



Re: [ccp4bb] Graphics cards for Coot, Pymol, Chimera on MacBook Pro Laptop

2015-03-18 Thread Xiao Lei
Hi Marc,

I have a Macbook pro Mid 2009 model (with integrated graphics card) and I
can run coot and pymol without any problem ( I haven't tested on Chimera),
I do not think a discrete graphics is needed. However, for pymol I can not
use the stereo function. I do not know if the discrete graphic card is
needed for this function.

Xiao

On Tue, Mar 17, 2015 at 1:12 PM, Marc Graille 
marc.grai...@polytechnique.edu wrote:

 Hello,

 I would like to buy a MacBook Pro laptop that will allow me among others
 to solve structures, build models and visualize electron density maps using
 Pymol, Coot or Chimera.
 I have the choice between between Intel Iris Pro (5200 series) and Intel Iris
 Pro + Nvidia GT 750M for the graphics cards but I don’t know which one is
 fine for the programs I want to run.
 Can some of you share advices/feedback with me?

 Thanks a lot for your answer.

 Best wishes,

 Marc


 Dr Marc GRAILLE

 Directeur de recherche CNRS

 Team: Translation and degradation of eukaryotic mRNAs

 Team supported by the ATIP-Avenir CNRS program

 Laboratoire de Biochimie

 ECOLE POLYTECHNIQUE - UMR7654 CNRS

 91128 PALAISEAU CEDEX

 Phone : +33 (0)1 69 33 48 90 – Fax : +33 (0)1 69 33 49 09

 Office 033012B

 Email: marc.grai...@polytechnique.edu

 http://bioc.polytechnique.fr/spip.php?rubrique117







Re: [ccp4bb] Off-topic - Crystallisation in anaerobic glove box

2015-03-18 Thread Julia Griese

Hi,

As far as I can tell oil does not block diffusion of O2 whatsoever. You 
can keep larger volumes (≥1 ml) of solutions anoxic in air for several 
hours with dithionite (≥0.5%) to scavenge oxygen and a redox indicator 
dye such as phenosafranin to monitor the state of the solution. Small 
drops (large surface/volume ratio) however oxidize within seconds, 
whether or not they are covered with oil. Of course this may simply be 
because the oxygen gets in before the drop is covered with oil, but 
either way I don't see how you could set up anaerobic drops in an 
aerobic environment.


Best,

Julia

On 18/03/15 14:47, Edward A. Berry wrote:
Do you have evidence that the oil blocks diffusion of O2? O2 is a 
nonpolar molecule, generally much more soluble in oils than in water. 
I'm not sure about silicone oils, but I would think they also dissolve 
O2 readily.

eab

On 03/18/2015 08:02 AM, Patrick Shaw Stewart wrote:


Hi Steve

I have one more comment for this thread.

The microbatch-under-oil method is very handy for anaerobic work:

1.  You can keep the microbatch stock solutions in normal 
microtitre plates (polypropylene is best to reduce evaporation) for 
months, which hugely reduces the amount of degassing that you need to 
do.  You will only use say 0.5 ul of stock per drop.


2.  The oil offers a surprising amount of protection from 
oxidation, which may be helpful eg in harvesting.


3.  Microbatch can be automated - in parallel to vapor diffusion 
if desired



It's amazing how often (aerobic) microbatch produces far superior 
crystals to V.D. for no obvious reason - it's well worth trying for 
both screening and optimization.


Best wishes

Patrick



On 11 March 2015 at 10:17, Stephen Carr 
stephen.c...@rc-harwell.ac.uk 
mailto:stephen.c...@rc-harwell.ac.uk wrote:


Dear CCP4BBer's

Apologies for the off-topic post, but the CCP4BB seems to be the 
best place to ask about crystallisation.


I am looking to set up crystallisation in an anaerobic glove box 
and wondered how other people did this, specifically the 
crystallisation stage.  My initial thoughts were to place a small 
crystallisation incubator inside the box, however the smallest I have 
come across so far (~27L) is still rather large.  Has anyone come 
across smaller incubators? Alternatively are incubators even 
neccessary if the glove box is placed in a room with good air 
conditioning and stable temperature control?


Any recommendations would be very helpful.

Thanks in advance,

Steve Carr

Dr Stephen Carr
Research Complex at Harwell (RCaH)
Rutherford Appleton Laboratory
Harwell Oxford
Didcot
Oxon OX11 0FA
United Kingdom
Email stephen.c...@rc-harwell.ac.uk 
mailto:stephen.c...@rc-harwell.ac.uk

tel 01235 567717 tel:01235%20567717

This email and any attachments may contain confidential, 
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intended addressee only. If you are not the intended addressee or an 
authorized recipient of the addressee, please notify us of receipt by 
returning the e-mail and do not use, copy, retain, distribute or 
disclose the information in or attached to this email.


Any views or opinions presented are solely those of the author 
and do not necessarily represent those of the Research Complex at 
Harwell.


There is no guarantee that this email or any attachments are free 
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may sustain as a result of software viruses which may be transmitted 
in or with the message.


We use an electronic filing system. Please send electronic 
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--
patr...@douglas.co.uk mailto:patr...@douglas.co.uk Douglas 
Instruments Ltd.

  Douglas House, East Garston, Hungerford, Berkshire, RG17 7HD, UK
  Directors: Peter Baldock, Patrick Shaw Stewart

http://www.douglas.co.uk
  Tel: 44 (0) 148-864-9090US toll-free 1-877-225-2034
  Regd. England 2177994, VAT Reg. GB 480 7371 36


--
Dr. Julia Griese
Postdoctoral Researcher
Stockholm Center for Biomembrane Research
Department of Biochemistry and Biophysics
Stockholm University
106 91 Stockholm
Sweden

phone: +46-(0)8-162 778
email: gri...@dbb.su.se


[ccp4bb] Antw: Re: [ccp4bb] Offtopic: Software to closely visualize interacting partnets in protein complex

2015-03-18 Thread Matthias Barone
Hi,
I just checked the PIC sever tim suggested. very nice indeed. If 
you only want to map different interfaces and the amino acids involved 
in, I suggest to run the pisa server, too. http://www.ebi.ac.uk/pdbe/pisa/ . I 
used it extensively to find out whether a certain set of crystal contacs leads 
to a certain crystal packing. 
best, matthias

 Tim tim.schu...@rub.de 11.03.15 18.25 Uhr 
Hi,
Molprobity is also a nice software to do this kind of analysis - if you 
use it as implemented in phenix you also get good visualization in coot.
I also asked the pymol community to create an implementation for pymol, 
but I did not follow if somebody took that up.

Also this 'protein interactions calculation' server is very neat:
http://pic.mbu.iisc.ernet.in/

/Tim


On 10/03/15 11:25, Debasish Kumar Ghosh wrote:
 Dear All,

 Apologies for this little off-topic inquiry. I want to closely visualize the 
 interacting residues in an multimeric protein complex to understand the 
 nature of interactions. Is there any good software to give this information 
 with good clarity.
 Any suggestion is highly appreciated.

 Thanks,
 Best !!!

 Debasish Kumar Ghosh

 CSIR- Junior Research Fellow (PhD Scholar)
 C/o: Dr. Akash Ranjan
 Computational and Functional Genomics Group
 Centre for DNA Fingerprinting and Diagnostics
 Hyderabad, INDIA

 Email(s): dkgh...@cdfd.org.in, dgho...@gmail.com
 Telephone: 0091-9088334375 (M), 0091-40-24749396 (Lab)
 Lab URL: 
 http://www.cdfd.org.in/labpages/computational_functional_genomics.html





Re: [ccp4bb] Off-topic - Crystallisation in anaerobic glove box

2015-03-18 Thread Ronald E Stenkamp

I also wondered about the statement about oils blocking diffusion of O2.  We 
had lots of trouble keeping things anaerobic in a glove box until we degassed 
the oils and waxes used to mount crystals in capillaries.  We found that 
putting them under vacuum removed much of the dissolved oxygen.  The waxes 
required cycling between heating and vacuum several times.  Ron

On Wed, 18 Mar 2015, Edward A. Berry wrote:

Do you have evidence that the oil blocks diffusion of O2? O2 is a nonpolar 
molecule, generally much more soluble in oils than in water. I'm not sure 
about silicone oils, but I would think they also dissolve O2 readily.

eab

On 03/18/2015 08:02 AM, Patrick Shaw Stewart wrote:


Hi Steve

I have one more comment for this thread.

The microbatch-under-oil method is very handy for anaerobic work:

1.  You can keep the microbatch stock solutions in normal microtitre 
plates (polypropylene is best to reduce evaporation) for months, which 
hugely reduces the amount of degassing that you need to do.  You will only 
use say 0.5 ul of stock per drop.


2.  The oil offers a surprising amount of protection from oxidation, 
which may be helpful eg in harvesting.


3.  Microbatch can be automated - in parallel to vapor diffusion if 
desired



It's amazing how often (aerobic) microbatch produces far superior crystals 
to V.D. for no obvious reason - it's well worth trying for both screening 
and optimization.


Best wishes

Patrick



On 11 March 2015 at 10:17, Stephen Carr stephen.c...@rc-harwell.ac.uk 
mailto:stephen.c...@rc-harwell.ac.uk wrote:


Dear CCP4BBer's

Apologies for the off-topic post, but the CCP4BB seems to be the best 
place to ask about crystallisation.


I am looking to set up crystallisation in an anaerobic glove box and 
wondered how other people did this, specifically the crystallisation stage. 
My initial thoughts were to place a small crystallisation incubator inside 
the box, however the smallest I have come across so far (~27L) is still 
rather large.  Has anyone come across smaller incubators?  Alternatively 
are incubators even neccessary if the glove box is placed in a room with 
good air conditioning and stable temperature control?


Any recommendations would be very helpful.

Thanks in advance,

Steve Carr

Dr Stephen Carr
Research Complex at Harwell (RCaH)
Rutherford Appleton Laboratory
Harwell Oxford
Didcot
Oxon OX11 0FA
United Kingdom
Email stephen.c...@rc-harwell.ac.uk 
mailto:stephen.c...@rc-harwell.ac.uk

tel 01235 567717 tel:01235%20567717

This email and any attachments may contain confidential, copyright and 
or privileged material, and are for the use of the intended addressee only. 
If you are not the intended addressee or an authorized recipient of the 
addressee, please notify us of receipt by returning the e-mail and do not 
use, copy, retain, distribute or disclose the information in or attached to 
this email.


Any views or opinions presented are solely those of the author and do 
not necessarily represent those of the Research Complex at Harwell.


There is no guarantee that this email or any attachments are free from 
viruses and we cannot accept liability for any damage which you may sustain 
as a result of software viruses which may be transmitted in or with the 
message.


We use an electronic filing system. Please send electronic versions of 
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This email may have a protective marking, for an explanation, please 
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patr...@douglas.co.uk mailto:patr...@douglas.co.ukDouglas Instruments 
Ltd.

  Douglas House, East Garston, Hungerford, Berkshire, RG17 7HD, UK
  Directors: Peter Baldock, Patrick Shaw Stewart

http://www.douglas.co.uk
  Tel: 44 (0) 148-864-9090US toll-free 1-877-225-2034
  Regd. England 2177994, VAT Reg. GB 480 7371 36




Re: [ccp4bb] Off-topic - Crystallisation in anaerobic glove box

2015-03-18 Thread Tristan Croll
It's a little complicated. It's true that oxygen is more soluble in most oils 
than in water - but in a high viscosity mineral oil the diffusion rate is 
orders of magnitude lower. So the combination of an oil overlay and a reducing 
agent in your buffer should protect your sample much longer than the reducing 
agent alone - as long as your oil was degassed to start with. Note that silicon 
oils are a bad choice for this - silicones have an enormous affinity for oxygen 
(so much so that they've been explored as artificial blood substitutes), and it 
diffuses through them very readily.

 
 
Tristan Croll
Lecturer
Faculty of Health
School of Biomedical Sciences
Institute of Health and Biomedical Engineering
Queensland University of Technology
60 Musk Ave
Kelvin Grove QLD 4059 Australia
+61 7 3138 6443
 
This email and its attachments (if any) contain confidential information 
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email by mistake, please notify the sender immediately and delete the original 
email.
 
 

 On 18 Mar 2015, at 11:49 pm, Edward A. Berry ber...@upstate.edu wrote:
 
 Do you have evidence that the oil blocks diffusion of O2? O2 is a nonpolar 
 molecule, generally much more soluble in oils than in water. I'm not sure 
 about silicone oils, but I would think they also dissolve O2 readily.
 eab
 
 On 03/18/2015 08:02 AM, Patrick Shaw Stewart wrote:
 
 Hi Steve
 
 I have one more comment for this thread.
 
 The microbatch-under-oil method is very handy for anaerobic work:
 
1.  You can keep the microbatch stock solutions in normal microtitre 
 plates (polypropylene is best to reduce evaporation) for months, which 
 hugely reduces the amount of degassing that you need to do.  You will only 
 use say 0.5 ul of stock per drop.
 
2.  The oil offers a surprising amount of protection from oxidation, 
 which may be helpful eg in harvesting.
 
3.  Microbatch can be automated - in parallel to vapor diffusion if 
 desired
 
 
 It's amazing how often (aerobic) microbatch produces far superior crystals 
 to V.D. for no obvious reason - it's well worth trying for both screening 
 and optimization.
 
 Best wishes
 
 Patrick
 
 
 
 On 11 March 2015 at 10:17, Stephen Carr stephen.c...@rc-harwell.ac.uk 
 mailto:stephen.c...@rc-harwell.ac.uk wrote:
 
Dear CCP4BBer's
 
Apologies for the off-topic post, but the CCP4BB seems to be the best 
 place to ask about crystallisation.
 
I am looking to set up crystallisation in an anaerobic glove box and 
 wondered how other people did this, specifically the crystallisation stage.  
 My initial thoughts were to place a small crystallisation incubator inside 
 the box, however the smallest I have come across so far (~27L) is still 
 rather large.  Has anyone come across smaller incubators?  Alternatively are 
 incubators even neccessary if the glove box is placed in a room with good 
 air conditioning and stable temperature control?
 
Any recommendations would be very helpful.
 
Thanks in advance,
 
Steve Carr
 
Dr Stephen Carr
Research Complex at Harwell (RCaH)
Rutherford Appleton Laboratory
Harwell Oxford
Didcot
Oxon OX11 0FA
United Kingdom
Email stephen.c...@rc-harwell.ac.uk mailto:stephen.c...@rc-harwell.ac.uk
tel 01235 567717 tel:01235%20567717
 
This email and any attachments may contain confidential, copyright and or 
 privileged material, and are for the use of the intended addressee only. If 
 you are not the intended addressee or an authorized recipient of the 
 addressee, please notify us of receipt by returning the e-mail and do not 
 use, copy, retain, distribute or disclose the information in or attached to 
 this email.
 
Any views or opinions presented are solely those of the author and do not 
 necessarily represent those of the Research Complex at Harwell.
 
There is no guarantee that this email or any attachments are free from 
 viruses and we cannot accept liability for any damage which you may sustain 
 as a result of software viruses which may be transmitted in or with the 
 message.
 
We use an electronic filing system. Please send electronic versions of 
 documents, unless paper is specifically requested.
 
This email may have a protective marking, for an explanation, please see:

 http://www.mrc.ac.uk/About/informationandstandards/documentmarking/index.htm.
 
 
 
 
 --
 patr...@douglas.co.uk mailto:patr...@douglas.co.ukDouglas Instruments 
 Ltd.
  Douglas House, East Garston, Hungerford, Berkshire, RG17 7HD, UK
  Directors: Peter Baldock, Patrick Shaw Stewart
 
 http://www.douglas.co.uk
  Tel: 44 (0) 148-864-9090US toll-free 1-877-225-2034
  Regd. England 2177994, VAT Reg. GB 480 7371 36


[ccp4bb] Group Leader position in Helsinki, Finland

2015-03-18 Thread Tommi Kajander
(Reposting this position as it didnt go to the jobs list..:)



On behalf of the search committee (see links below):

--

The Institute of Biotechnology is a leading European research institute within 
the University of Helsinki with a mission to increase knowledge in 
cross‐disciplinary biology and biotechnology. The Institute has state‐ofthe‐art 
facilities in imaging, model organisms, proteomics, genomics, crystallography 
and NMR.

We seek outstanding candidates for GROUP LEADER positions in the areas of 
Molecular Cell Biology, Genomics and Quantitative Biology, Plant Biology, 
Developmental Biology, or Structural Biology and Biophysics.

Applicants from different levels of the career path are welcomed.
Successful candidates have a suitable strong track record including a PhD or an 
equivalent and postdoctoral experience in an international setting and are 
expected to develop an independent externally funded line of research. 
Appointments are based on BI tenuring system with external evaluations every 
four years. A globally competitive remuneration package and 3‐year startup 
funds are negotiable.
Applications should include a presentation of past achievements (1 page) and 
research interests (max. 3 pages), curriculum vitae, list of publications (with 
citation numbers), and three letters of reference.
Applications and letters of reference are to be submitted at 
www.biocenter.helsinki.fi/bi/recruit no later than on Tuesday March 31, 2015.

For further information and detailed contacts, please visit 
www.biocenter.helsinki.fi/bi/recruit or contact bi‐direc...@helsinki.fi.

www.biocenter.helsinki.fi/bi





Tommi Kajander, Ph.D.
Team Leader
Structural Biology and Biophysics
Institute of Biotechnology
University of Helsinki
Viikinkaari 1 (P.O. Box 65)
00014 Helsinki
Finland
p. +358-50-4480991
tommi.kajan...@helsinki.fi
http://www.biocenter.helsinki.fi/bi/kajander/



[ccp4bb] Mosquito Tips (4.5mm / 9.0mm)

2015-03-18 Thread Paul Smith
Hello CCP4,

Sorry for the labware related post, but I think this is the right audience.

I have 4 new reels of mosquito tips with 4.5mm pitch (for 384 well setups,
TTP labtech part number 4150-03010).  I only use 96well format, thus am
looking to swap these for 9mm pitch (part number 4150-03020).

Anyone out there in the reverse situation or sitting on a surplus of 9mm
tips?

Thanks,

--Paul

-- 

Nothing can be more incorrect than the assumption one sometimes meets
with, that physics has one method, chemistry another, and biology a third.
--Thomas Huxley
+
Dr. Paul Smith
Assistant Professor
Department of Chemistry
Fordham University
441 E. Fordham Road
Bronx, NY 10458
phone: 718-817-4461
fax: 718-817-4432
email: psmit...@fordham.edu
office: JMH 638
http://www.fordham.edu/academics/programs_at_fordham_/chemistry/index.asp
http://www.fordham.edu/academics/sciences_at_fordham/


Re: [ccp4bb] Off-topic - Crystallisation in anaerobic glove box

2015-03-18 Thread Edward A. Berry

Actually I may have misunderstood the original post. Patrick never said oils 
block O2 diffusion:

On 03/18/2015 09:47 AM, Edward A. Berry wrote:






The microbatch-under-oil method is very handy for anaerobic work:

(In a glove box, of course)


1.  You can keep the microbatch stock solutions in normal microtitre plates 
(polypropylene is best to reduce evaporation) for months, which hugely reduces 
the amount of degassing that you need to do.  You will only use say 0.5 ul of 
stock per drop.

  (reagents including oils stored in a tray in the glove box to reduce 
degassing time)


2.  The oil offers a surprising amount of protection from oxidation, which 
may be helpful eg in harvesting.

Perhaps by the O2-buffering effect of anoxic oil that Tristan mentioned, and by 
preventing an air/water interface where a skin forms and interferes with 
harvesting.



3.  Microbatch can be automated - in parallel to vapor diffusion if desired



And now as an aside, the advantages of oil for aerobic (oxic) work:

It's amazing how often (aerobic) microbatch produces far superior crystals to 
V.D. for no obvious reason - it's well worth trying for both screening and 
optimization.



If that was what was meant I apologize, but at least this will prevent someone 
else from getting the wrong Idea as I did.

eab


Re: [ccp4bb] Graphics cards for Coot, Pymol, Chimera on MacBook Pro Laptop

2015-03-18 Thread mesters

Hello Marc,

obvious differences between card are memory bandwidth, intel 13 GB/sec 
vs. nvidia 29 GB/s, the texture rate, 2 GTexel/s vs. 31 GTexel/s, and 
pixel rate,  0.5 GPix/s vs. 15.5 GPix/s. Some of these values result 
because of graphics memory differences. There is no difference in energy 
consumption. Question is indeed, what do you need for doing 
crystallography. If you look at the performance in popular games, the 
difference is much less than you would expect looking only at the naked 
values. The intel is merely 20% slower than the nvidia in most reference 
games So, not worth spending the extra money I would say as the 
actual graphics performance between cards is similar.


However, if you plan to process a lot of graphical data (video editing, 
etc), the nvidia will by far out-perform the intel. Otherwise, the Intel 
Iris Pro model is more than fine and you better invest your money by 
getting more memory.


Best wishes

Jeroen


On 17 Mar 2015, at 16:12, Marc Graille marc.grai...@polytechnique.edu 
mailto:marc.grai...@polytechnique.edu wrote:


Hello,

I would like to buy a MacBook Pro laptop that will allow me among others 
to solve structures, build models and visualize electron density maps 
using Pymol, Coot or Chimera.
I have the choice between between Intel Iris Pro (5200 series) and 
Intel Iris Pro + Nvidia GT 750M for the graphics cards but I don’t know 
which one is fine for the programs I want to run.

Can some of you share advices/feedback with me?

Thanks a lot for your answer.

Best wishes,

Marc


--
Dr.math. et dis. nat. Jeroen R. Mesters
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Coordinator master's program Infection Biology

Institute of Biochemistry, University of Lübeck
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phone: +49-451-5004065 (secretariate -5004061)
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http://www.uni-luebeck.de/studium/studiengaenge/infection-biology
http://www.iobcr.org Http://www.iobcr.org


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and which will not, speak then to me who neither beg nor fear 
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