4LPW

Crystal structure of TENCON variant A6

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	95
Detector technology	CCD
Collection date	2010-04-01
Detector	RIGAKU SATURN 944
Wavelength(s)	1.5418
Spacegroup name	P 21 3
Unit cell lengths	99.330, 99.330, 99.330
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.700 - 2.800
R-factor	0.186
Rwork	0.182
R-free	0.21950
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3tes
RMSD bond length	0.008
RMSD bond angle	1.206
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.1_1168))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.870
High resolution limit [Å]	2.800	2.800
Rmerge	0.076	0.450
Number of reflections	8281
Completeness [%]	99.9	100
Redundancy	11.1	11.2

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	293	0.1 M sodium acetate, pH 5.5, 26% PEG3350, 0.2 M ammonium sulfate, VAPOR DIFFUSION, SITTING DROP, temperature 293K