6BAU

Crystal Structure of GltPh R397C in complex with L-Cysteine

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	100
Detector technology	CCD
Collection date	2014-06-28
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.953700
Spacegroup name	P 61
Unit cell lengths	115.313, 115.313, 322.274
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	40.000 - 3.800
R-factor	0.268
Rwork	0.267
R-free	0.28980
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2nwx
RMSD bond length	0.013
RMSD bond angle	1.052
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	REFMAC (5.5.0109)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.340	4.010
High resolution limit [Å]	3.800	3.800
Rmerge	0.103	0.741
Rmeas	0.125	0.905
Rpim	0.069	0.508
Number of reflections	23104	10244
<I/σ(I)>	6.2	1.4
Completeness [%]	96.9	98.4
Redundancy	3	3
CC(1/2)	0.991	0.723

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	277	50 mM citric acid 50 mM Disodium phosphate 100 mM Lithium sulfate 15-23% PEG1000