5F5K

E.Coli GlpG Y205F mutant complexed with aldehyde inhibitor in DMPC/CHAPSO bicelle

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CHESS BEAMLINE F1
Synchrotron site	CHESS
Beamline	F1
Temperature [K]	100
Detector technology	CCD
Collection date	2015-03-20
Detector	ADSC QUANTUM 270
Wavelength(s)	0.972
Spacegroup name	C 2 2 21
Unit cell lengths	70.320, 96.120, 62.670
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	50.010 - 2.400
R-factor	0.23707
Rwork	0.234
R-free	0.28807
RMSD bond length	0.011
RMSD bond angle	1.348
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0103)

Data quality characteristics

	Overall
Low resolution limit [Å]	50.010
High resolution limit [Å]	2.300
Number of reflections	9474
<I/σ(I)>	5.8
Completeness [%]	97.6
Redundancy	5.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	2.5M NaCl, 0.1M Sodium Acetate pH 5, 5% Glycerol, 7% DMPC/CHAPSO bicelle