5GZP

Y74COX MUTANT OF PLASMODIUM FALCIPARUM TRIOSEPHOSPHATE ISOMERASE

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU RU200
Temperature [K]	100
Detector technology	CCD
Collection date	2012-03-10
Detector	MARRESEARCH
Wavelength(s)	1.54179
Spacegroup name	P 21 21 21
Unit cell lengths	64.990, 67.430, 141.140
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.750 - 2.030
R-factor	0.18225
Rwork	0.180
R-free	0.23290
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1lyx
RMSD bond length	0.018
RMSD bond angle	1.861
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.750	2.087
High resolution limit [Å]	2.030	2.034
Rmerge	0.058
Number of reflections	37957
<I/σ(I)>	18.2
Completeness [%]	98.3
Redundancy	6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	290	HEPES 100mM pH7, PEG 8000, EDTA 10mM, CaCl2 10mM, Sodium Azide 0.006% Protein 10mg/mL