6IXW

pCBH ParM non-polymerisable quadruple mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE TPS 05A
Synchrotron site	NSRRC
Beamline	TPS 05A
Temperature [K]	100
Detector technology	CCD
Collection date	2016-10-12
Detector	RAYONIX MX300-HS
Wavelength(s)	1
Spacegroup name	C 1 2 1
Unit cell lengths	164.153, 93.922, 114.699
Unit cell angles	90.00, 131.55, 90.00

Refinement procedure

Resolution	19.974 - 3.253
R-factor	0.1607
Rwork	0.158
R-free	0.21400
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	20.000	20.000	3.310
High resolution limit [Å]	3.250	8.590	3.250
Rmerge	0.143	0.040	0.574
Rmeas	0.170	0.048	0.696
Rpim	0.091	0.026	0.388
Number of reflections	20481	1056	995
<I/σ(I)>	6.8
Completeness [%]	99.9	100	99.1
Redundancy	3.5	3.4	3.2
CC(1/2)		0.995	0.562

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		288	28% PEG 400 0.1 M Hepes 0.15 M MgCl2 pH 7.5