4FDM

Crystallization and 3D structure elucidation of thermostable L2 lipase from thermophilic locally isolated Bacillus sp. L2.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL41XU
Synchrotron site	SPring-8
Beamline	BL41XU
Temperature [K]	100
Detector technology	CCD
Collection date	2009-12-17
Detector	ADSC QUANTUM 315
Wavelength(s)	0.8
Spacegroup name	P 21 21 21
Unit cell lengths	71.977, 81.784, 83.374
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	32.930 - 1.600
R-factor	0.16936
Rwork	0.168
R-free	0.18912
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2dsn
RMSD bond length	0.014
RMSD bond angle	1.451
Refinement software	REFMAC (5.5.0072)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	1.670	1.510
High resolution limit [Å]	1.500	1.630	1.480
Number of reflections	77987
<I/σ(I)>		12	6.2
Completeness [%]	99.8	99.9	90.3
Redundancy			13.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	LIQUID DIFFUSION	6.5	293.15	20% PEG 6000, 50mM MES, 50mM NaCl, Counter-diffusion, temperature 293.15K, pH 6.5, LIQUID DIFFUSION