3U5V

Crystal structure of Max-E47

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS BEAMLINE X25
Synchrotron site	NSLS
Beamline	X25
Temperature [K]	100
Detector technology	CCD
Collection date	2010-10-30
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.1
Spacegroup name	I 21 21 21
Unit cell lengths	37.480, 49.466, 74.100
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	23.256 - 1.700
R-factor	0.2082
Rwork	0.207
R-free	0.23500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2ql2
RMSD bond length	0.003
RMSD bond angle	0.567
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASES
Refinement software	PHENIX ((phenix.refine: 1.7_650))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	40.000	40.000	1.730
High resolution limit [Å]	1.700	4.610	1.700
Rmerge	0.063	0.034	0.647
Number of reflections	7852
<I/σ(I)>	32.1	46.5	2.1
Completeness [%]	99.7	97.5	98.5
Redundancy	8.9	9	4.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.6	277	5% glycerol, 3.2-3.5 M sodium nitrate, 0.1 M sodium acetate anhydrous, pH 4.6, VAPOR DIFFUSION, HANGING DROP, temperature 277K