4HK0

UCA Fab (unbound) from CH65-CH67 Lineage

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 24-ID-E
Synchrotron site	APS
Beamline	24-ID-E
Temperature [K]	100
Detector technology	CCD
Collection date	2012-02-17
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97919
Spacegroup name	P 62
Unit cell lengths	102.004, 102.004, 163.085
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	37.195 - 2.497
R-factor	0.2087
Rwork	0.206
R-free	0.25840
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.013
RMSD bond angle	1.603
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	PHENIX (1.7.3_928)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.540
High resolution limit [Å]	2.497	6.780	2.497
Rmerge	0.078	0.033	0.365
Number of reflections	33216
<I/σ(I)>	10.4
Completeness [%]	99.7	100	99.1
Redundancy	7.2	7.4	7.1

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5	291	1.6 M ammonium sulfate, 100 mM sodium acetate, pH 5.0, VAPOR DIFFUSION, HANGING DROP, temperature 291K