5KIO

PSEUDO T4 LYSOZYME MUTANT - Y18PHE-I

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-003
Temperature [K]	100
Detector technology	PIXEL
Collection date	2014-07-13
Detector	DECTRIS PILATUS 200K
Wavelength(s)	1.54
Spacegroup name	P 32 2 1
Unit cell lengths	60.103, 60.103, 96.080
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	32.030 - 1.630
R-factor	0.195
Rwork	0.191
R-free	0.23700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1l63
RMSD bond length	0.006
RMSD bond angle	1.048
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (dev_1951)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	32.030	50.000	1.660
High resolution limit [Å]	1.630	4.420	1.630
Rmerge	0.098	0.063	0.792
Number of reflections	25701
<I/σ(I)>	31
Completeness [%]	99.0	99.6	100
Redundancy	8.5	18.7	6

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.7	291.15	2.0M KPO4, 50MM 2-HYDROXYETHYLDISULFIDE, 50MM 2-MERCAPTOETHANOL, PH 6.7