4U1T

The crystal structure of holo CalE6, a methionine gamma lyase from Micromonospora echinospora

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	100
Detector technology	CCD
Collection date	2012-10-15
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9793
Spacegroup name	I 2 2 2
Unit cell lengths	146.170, 146.220, 348.091
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.661 - 2.000
R-factor	0.1532
Rwork	0.151
R-free	0.18430
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3qi6
RMSD bond length	0.008
RMSD bond angle	1.070
Data scaling software	iMOSFLM
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.4_1496))

Data quality characteristics

	Overall
Low resolution limit [Å]	47.700
High resolution limit [Å]	2.000
Number of reflections	294248
<I/σ(I)>	17
Completeness [%]	99.9
Redundancy	2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.5	294	0.2 M ammonium sulfate, 0.1 M Bis-Tris, 17% PEG 3350