3BZP

Crystal structural of the mutated N262A EscU C-terminal domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	100
Detector technology	CCD
Collection date	2007-01-01
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97956
Spacegroup name	I 2 2 2
Unit cell lengths	56.535, 59.169, 71.930
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.690 - 1.499
R-factor	0.19456
Rwork	0.194
R-free	0.21300
RMSD bond length	0.015
RMSD bond angle	1.634
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	PHASER
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	50.000	50.000	1.550
High resolution limit [Å]	1.499	3.230	1.499
Rmerge	0.051	0.035	0.400
Number of reflections	18747
<I/σ(I)>	12.8
Completeness [%]	94.9	81.9	90.4
Redundancy	7	6.5	5.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	5.5	293	Citrate, PEG 6000, t-Butanol, pH 5.5, Microbatch, temperature 293K