6QYH

Structure of Apo HPAB from E.coli

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 1
Synchrotron site	SOLEIL
Beamline	PROXIMA 1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-05-27
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97857
Spacegroup name	P 65 2 2
Unit cell lengths	189.280, 189.280, 163.530
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	19.450 - 1.940
R-factor	0.167
Rwork	0.166
R-free	0.18400
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4oo2
RMSD bond length	0.010
RMSD bond angle	0.960
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER (2.6.0)
Refinement software	BUSTER (2.10.3)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.400	2.010
High resolution limit [Å]	1.940	1.940
Rmerge	0.161	3.410
Rmeas	0.164	3.478
Rpim	0.032	0.677
Number of reflections	127313	12389
<I/σ(I)>	13.3	1
Completeness [%]	99.9	98.8
Redundancy	26.13	25.84
CC(1/2)	0.999	0.472

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	291	HEPES 0.1M pH 7.5 PEG 400 30% (w/v) CaCl2 0.2M MgCl2 0.1M