6KQW

Crystal structure of Yijc from B. subtilis

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL15A1
Synchrotron site	NSRRC
Beamline	BL15A1
Temperature [K]	100
Detector technology	CCD
Collection date	2018-12-11
Detector	RAYONIX MX-300
Wavelength(s)	1.0
Spacegroup name	I 2 2 2
Unit cell lengths	51.819, 116.845, 187.660
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	23.811 - 2.180
R-factor	0.2246
Rwork	0.223
R-free	0.25000
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3iaa
RMSD bond length	0.004
RMSD bond angle	0.748
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]	25.000	25.000	2.260
High resolution limit [Å]	2.180	4.690	2.180
Rmerge	0.052	0.021	0.730
Rmeas	0.059	0.025	0.832
Rpim	0.028	0.012	0.394
Total number of observations	133014
Number of reflections	30469	3204	3012
<I/σ(I)>	14.4
Completeness [%]	99.9	99.4	99.9
Redundancy	4.4	4.2	4.4
CC(1/2)		0.999	0.759

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	295	1.2 M tri-Sodium Citrate dehydrate, 0.1 M Bis-Tris Propane