2PJQ

Crystal structure of Q88U62_LACPL from Lactobacillus plantarum. Northeast Structural Genomics target LpR71

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X4A
Synchrotron site	NSLS
Beamline	X4A
Temperature [K]	100
Detector technology	CCD
Collection date	2007-04-03
Detector	ADSC QUANTUM 4
Wavelength(s)	0.97950, 0.97900, 0.95000
Spacegroup name	P 21 21 2
Unit cell lengths	79.928, 167.442, 63.769
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	20.000 - 2.800
R-factor	0.236
Rwork	0.236
R-free	0.30700
Structure solution method	MAD
RMSD bond length	0.013
RMSD bond angle	1.613
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SnB
Refinement software	CNS (1.1)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.900
High resolution limit [Å]	2.800	6.030	2.800
Rmerge	0.147	0.074	0.522
Number of reflections	41034
<I/σ(I)>	8.7
Completeness [%]	99.6	99.9	98.9
Redundancy	3.9	4	3.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH UNDER OIL	4	293	0.1M KNO3, 0.1M Na3 citrate pH 4.0, 40% PEG1000, MICROBATCH UNDER OIL, temperature 293K
1	MICROBATCH UNDER OIL	4	293	0.1M KNO3, 0.1M Na3 citrate pH 4.0, 40% PEG1000, MICROBATCH UNDER OIL, temperature 293K
1	MICROBATCH UNDER OIL	4	293	0.1M KNO3, 0.1M Na3 citrate pH 4.0, 40% PEG1000, MICROBATCH UNDER OIL, temperature 293K