4MZM

MazF from S. aureus crystal form I, P212121, 2.1 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	2010-05-05
Detector	ADSC QUANTUM 315r
Spacegroup name	P 21 21 21
Unit cell lengths	60.692, 65.190, 112.011
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.480 - 2.100
R-factor	0.177
Rwork	0.175
R-free	0.22800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ne8
RMSD bond length	0.007
RMSD bond angle	1.088
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	CCP4 ((PHASER))
Refinement software	PHENIX ((phenix.refine: 1.6.1_357))

Data quality characteristics

	Overall
Low resolution limit [Å]	56.340
High resolution limit [Å]	2.100
Rmerge	0.104
Number of reflections	26598
<I/σ(I)>	14
Completeness [%]	99.8
Redundancy	5.4

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		4.6	293	0.2 M NH4Ac, 0.1 M NaAc pH 4.6, 30% (w/v) PEG 4000, VAPOR DIFFUSION, HANGING DROP, temperature 293K