1SYR

Initial Structural Analysis of Plasmodium falciparum thioredoxin

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	CCD
Collection date	2003-11-11
Detector	ADSC QUANTUM 210
Wavelength(s)	1.0781
Spacegroup name	C 2 2 21
Unit cell lengths	108.189, 201.308, 200.504
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	30.000 - 2.950
R-factor	0.1988
Rwork	0.197
R-free	0.23616
Structure solution method	MAD
RMSD bond length	0.009
RMSD bond angle	1.132
Data reduction software	MOSFLM
Data scaling software	CCP4 ((SCALA))
Phasing software	SHARP
Refinement software	REFMAC (5.1.24)

Data quality characteristics

	Overall
Low resolution limit [Å]	70.000
High resolution limit [Å]	2.950
Number of reflections	46209
<I/σ(I)>	18.1
Completeness [%]	99.5
Redundancy	13.6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4	293	Ammonium sulfate, sodium citrate, pH 4, VAPOR DIFFUSION, SITTING DROP, temperature 293K
1	VAPOR DIFFUSION, SITTING DROP	4	293	Ammonium sulfate, sodium citrate, pH 4, VAPOR DIFFUSION, SITTING DROP, temperature 293K
1	VAPOR DIFFUSION, SITTING DROP	4	293	Ammonium sulfate, sodium citrate, pH 4, VAPOR DIFFUSION, SITTING DROP, temperature 293K