5V5Z

Structure of CYP51 from the pathogen Candida albicans

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX2
Synchrotron site	Australian Synchrotron
Beamline	MX2
Temperature [K]	91
Detector technology	CCD
Collection date	2015-02-21
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.954
Spacegroup name	P 2 21 21
Unit cell lengths	91.940, 92.510, 101.530
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.505 - 2.900
R-factor	0.2214
Rwork	0.219
R-free	0.26860
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4lxj
RMSD bond length	0.011
RMSD bond angle	1.228
Data reduction software	MOSFLM
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	91.940	3.080
High resolution limit [Å]	2.900	2.900
Rmerge	0.200	1.235
Number of reflections	19796	3130
<I/σ(I)>	8.6	1.7
Completeness [%]	99.9	100
Redundancy	7.5	7.6
CC(1/2)	0.996	0.799

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.8	291	0.5 M GLYCINE-NAOH, 35% PEG400,