Hi,

"Question posed in a different way - One experienced crystallographer is being 
supplied with crystals of proteins - how many can one solve in a year (40 hour 
weeks, with 5 week holidays)."
  
  Under your assumptions with slight modifications (median length ~365 aa, all 
Se-Met-mostly MAD, some SAD, average resolution ~2.0A or better), rate of 
structure determination at JCSG for the past week is 168 protein structures 
with of which ~84% are unique.
  The rate of structure determination is calculated every week and varies a bit 
and can be found at:

http://www.mcsg.anl.gov/ (Click on the tab "SG Progress" on the left. 
Information on how the statistics are arrived at is also presented.

"The number of structures deposited in the PDB is increasing, the number of 
groups doing structural work is also increasing.  Given these two scenarios - 
how much has efficiency increased? We know average quality has not improved :-)"

  According to your paper in Acta D, 2007, "Multivariate statistical analysis 
revealed that while technological improvements have increased the number of 
structures determined, the overall quality of structures has remained constant. 
The quality of structures deposited by structural genomics initiatives are 
generally better than the quality of structures from individual investigator 
laboratories"
  
  Doesn't the above imply that since the quality of SG structures is better 
than the quality from non-SG, there has been improvement in quality?

 Efficiency has definitely improved given the total no. of structures being 
solved which has brought down the dollar cost per structure. I believe there 
are a couple of publications which discuss the reduction in cost per structure 
from ~$250K for non-SG labs to ~$100K or below for SG structures (taking all 
costs into account).

Regards,
Debanu.

--
Debanu Das,
JCSG, SSRL.
   

-----Original Message-----
From: CCP4 bulletin board [mailto:[EMAIL PROTECTED] On Behalf Of Ramaswamy
Sent: Tuesday, March 18, 2008 4:03 PM
To: CCP4BB@JISCMAIL.AC.UK
Subject: [ccp4bb] Off-topic structural genomics related question.

        Hello all,

        I apologize for this slightly off topic structural genomics kind of 
question(s).

The number of structures deposited in the PDB is increasing, the number of 
groups doing structural work is also increasing.  Given these two scenarios - 
how much has efficiency increased? We know average quality has not improved :-)

        Question posed in a different way - One experienced crystallographer is 
being supplied with crystals of proteins - how many can one solve in a year (40 
hour weeks, with 5 week holidays).

Assumptions:
1. The average size of the protein is 250 amino acids.
2. All are MAD structures with Se-Met readily available 3. Beam time is not 
bottle neck.
4. Average resolution 2.3-2.5 (so, there are some at 3.0 and some at 1.5A 
resolution).

        May be some of the SG groups or PX beamlines have already computed 
numbers like these.  I would appreciate if they are shared with me (along with 
the assumptions that have gone into the calculations).

        Thanks.

        Rams.
S. Ramaswamy.
Department of Biochemistry
University of Iowa.

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