4MZP

MazF from S. aureus crystal form III, C2221, 2.7 A

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	CCD
Collection date	2011-02-10
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0394
Spacegroup name	C 2 2 21
Unit cell lengths	90.881, 92.636, 222.376
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	39.200 - 2.702
R-factor	0.2103
Rwork	0.208
R-free	0.24260
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4mzm
RMSD bond length	0.014
RMSD bond angle	1.328
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	CCP4 ((Phaser))
Refinement software	PHENIX ((phenix.refine: 1.7_650))

Data quality characteristics

	Overall
Low resolution limit [Å]	39.200
High resolution limit [Å]	2.700
Rmerge	0.093
Number of reflections	25526
<I/σ(I)>	13.3
Completeness [%]	98.0
Redundancy	3.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	293	2.0 M (NH4)2SO4, 0.1 M NAAC pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 293K