3V85

1.9 Angstrom resolution crystal structure of the protein Q9SIY3 from Arabidopsis thaliana

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CHESS BEAMLINE F2
Synchrotron site	CHESS
Beamline	F2
Temperature [K]	100
Detector technology	CCD
Collection date	2010-06-21
Detector	ADSC QUANTUM 210
Wavelength(s)	0.97860
Spacegroup name	P 1 21 1
Unit cell lengths	44.776, 33.952, 71.596
Unit cell angles	90.00, 95.23, 90.00

Refinement procedure

Resolution	19.729 - 1.900
R-factor	0.1749
Rwork	0.172
R-free	0.23000
Structure solution method	SAD
RMSD bond length	0.006
RMSD bond angle	1.035
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	SOLVE
Refinement software	PHENIX ((phenix.refine: dev_237))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.730	2.000
High resolution limit [Å]	1.900	1.900
Rmerge	0.117	0.697
Number of reflections	17111
<I/σ(I)>	9.8	3.5
Completeness [%]	99.4	98.7
Redundancy	3.6	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.4	298	0.1M NaCitrate, 0.25M NH4(OAc), 30% PEG4000, pH 5.4, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K
1	VAPOR DIFFUSION, HANGING DROP	5.4	298	0.1M NaCitrate, 0.25M NH4(OAc), 30% PEG4000, pH 5.4, VAPOR DIFFUSION, HANGING DROP, temperature 298.0K