Report on BUSTER refinement run in directory ./1pmq_04_ab_cation_two

Refinement vital statistics
	initial	final
N_cycles big	`0`	`3`
N_cycles small	`0`	`144`
X-ray weight	`4.00`	`4.90`
R_work	`0.2192`	`0.2044`
R_free	`0.2459`	`0.2337`
*100(R_free-R_work)**	`2.7%`	`2.9%`
LLG_work (cumulative Log-Likelihood Gain, working set)	`0`	`0.0846`
LLG_free (cumulative Log-Likelihood Gain, free set)	`0`	`0.0176`
RMS bond in Å	`0.0094`	`0.0088`
RMS angle in degrees	`0.99`	`0.97`
High resolution limit in Å	`2.10`	`2.10`
Low resolution limit in Å	`16.94`	`16.94`
Number of waters	`54`	`54`
help? see BUSTER wiki Refinement vital statistics

reciprocal space correlation coefficient plots
start `mtv svg agr png pdf`	final `mtv svg agr png pdf`
help? see BUSTER wiki interpreting reciprocal-space CC plots

Run conditions
refine command	`/mnt/public/xtal/Server-nightly-beta-consortium-linux64/autoBUSTER/bin/linux64/refine -p 1pmq_03_cation880-twoalts_init.pdb -m 1pmq/1pmq.mtz -l 880_cation.grade.cif -Gelly 03_occupancy_refine.Gelly -M TLSbasic -nbig 3 -d /scratch/osmart/2014/11/./1pmq_04_ab_cation_two_alts`
BUSTER version, run at, by user	`2.11.6, Fri Nov 7 18:24:51 GMT 2014, osmart`
in directory	`/home/osmart/2014/11/1pmq_rerefine`
nthreads, hostname, OS	`6, hypatia, Ubuntu precise (12.04.4 LTS)`
buster-report command	`/public/xtal/Server-nightly-beta-consortium-linux64/scripts/buster-report -d ./1pmq_04_ab_cation_two_alts -f`
buster-report version, run at, by user	`1.1.3 <July 23 2014>, Fri Nov 7 18:31:09 2014, osmart`
buster-report run on refine directory	`/home/osmart/2014/11/1pmq_rerefine/1pmq_04_ab_cation_two_alts`
buster-report output directory	`/home/osmart/2014/11/1pmq_rerefine/1pmq_04_ab_cation_two_alts-report`
final pdb coordinates	`1pmq_04_ab_cation_two_alts.pdb`
final mtzfile	`1pmq_04_ab_cation_two_alts.mtz`
this report pdf version	`report.pdf`
this report tsv version	`report.tsv`
this report xml version	`report.xml`
help? see BUSTER wiki Run conditions table