3Q79

Cryptococcus neoformans protein farnesyltransferase in complex with farnesyl-DDPTASACNIQ product

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 12.3.1
Synchrotron site	ALS
Beamline	12.3.1
Temperature [K]	100
Detector technology	CCD
Collection date	2010-04-21
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9795
Spacegroup name	P 43 21 2
Unit cell lengths	141.900, 141.900, 130.130
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	47.954 - 2.506
R-factor	0.2141
Rwork	0.212
R-free	0.25810
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.004
RMSD bond angle	0.737
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.6.1_336)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.600
High resolution limit [Å]	2.500	2.500
Number of reflections	44750
Completeness [%]	96.3	66.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	9.5	290	15% PEG 4K, 100mM CAPSO pH 9.5, 100mM NaCl, 150mM Lithium sulfate, VAPOR DIFFUSION, HANGING DROP, temperature 290K