4Z58

HipB-O3 20mer complex

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU FR-E+ SUPERBRIGHT
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2013-01-06
Detector	RIGAKU RAXIS IV
Wavelength(s)	1.5418
Spacegroup name	P 41 3 2
Unit cell lengths	126.941, 126.941, 126.941
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.880 - 2.500
R-factor	0.1937
Rwork	0.192
R-free	0.20820
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4Z52
RMSD bond length	0.003
RMSD bond angle	0.822
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHASER
Refinement software	PHENIX ((phenix.refine: 1.8.1_1168))

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	2.540
High resolution limit [Å]	2.500	6.780	2.500
Rmerge	0.081	0.031	0.849
Total number of observations	283883
Number of reflections	12717
<I/σ(I)>	11.6
Completeness [%]	100.0	100	100
Redundancy	22.3	19.9	20.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5	298	1 M sodium citrate