[ccp4bb] Off-topic: PDB statistics

2013-04-15 Thread Raji Edayathumangalam
Hi Folks, Does anyone know of an accurate way to mine the PDB for what percent of total X-ray structures deposited as on date were done using molecular replacement? I got hold of a pie chart for the same from my Google search for 2006 but I'd like to get hold of the most current statistics, if

Re: [ccp4bb] Off-topic: PDB statistics

2013-04-15 Thread Tim Gruene
-BEGIN PGP SIGNED MESSAGE- Hash: SHA1 Dear Raji, the numbers you have accumulated might already be accurate, it is more a question of how precise your numbers should be - and this might become a long discussion without resulting in a single answer: Take into account that the PDB query

Re: [ccp4bb] Off-topic: PDB statistics

2013-04-15 Thread Fischmann, Thierry
] Off-topic: PDB statistics Hi Folks, Does anyone know of an accurate way to mine the PDB for what percent of total X-ray structures deposited as on date were done using molecular replacement? I got hold of a pie chart for the same from my Google search for 2006 but I'd like to get hold

Re: [ccp4bb] Off-topic: PDB statistics

2013-04-15 Thread Phil Jeffrey
From my own db program: Number of entries in histogram: 711 Total number of instances : 78467 0 48249 0.6149 MOLECULAR REPLACEMENT 1 8557 0.1091 NULL 2 5632 0.0718 SAD 3 5128 0.0654 MAD 4 3600 0.0459 FOURIER SYNTHESIS 5 1762 0.0225 OTHER 6 1171 0.0149 MIR 7

Re: [ccp4bb] Off-topic: PDB statistics

2013-04-15 Thread Raji Edayathumangalam
Thanks to everyone who responded. I appreciate your pointing out the caveats of such statistics mining expeditions. I remember (with no accuracy or precision) sitting in a lecture by Wayne Hendrickson years ago and watching him cringe at the notion of considering the simple case of difference

Re: [ccp4bb] Off-topic: PDB statistics

2013-04-15 Thread Ethan A Merritt
On Mon, 15 Apr 2013, Raji Edayathumangalam wrote: Hi Folks, Does anyone know of an accurate way to mine the PDB for what percent of total X-ray structures deposited as on date were done using molecular replacement? I got hold of a pie chart for the same from my Google search for 2006 but I'd

Re: [ccp4bb] Off-topic: PDB statistics

2013-04-15 Thread James Holton
The only way to really do creative stats on the PDB is to just download the whole thing. It is a sobering thought to realize just how tiny it is! Less than 17 GB. Once you've got it all on your hard disk you can start writing little programs to look for different things. I have posted

Re: [ccp4bb] Off-topic: PDB statistics

2013-04-15 Thread Nat Echols
On Mon, Apr 15, 2013 at 11:47 AM, James Holton jmhol...@lbl.gov wrote: However, I'm sure the day is not far off when phenix.refine or the like will check if the starting R factor is too high and just automatically invoke a run of MR to see if something clicks. I think the latest Phaser code