7YU1

Structure of 6-aminohexanoate-oligomer hydrolase NylC precursor, D122G/H130Y/T267C mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PHOTON FACTORY BEAMLINE AR-NW12A
Synchrotron site	Photon Factory
Beamline	AR-NW12A
Temperature [K]	100
Detector technology	CCD
Collection date	2010-12-12
Detector	ADSC QUANTUM 210
Wavelength(s)	1.0000
Spacegroup name	C 2 2 21
Unit cell lengths	69.879, 144.004, 129.284
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.269 - 1.130
Rwork	0.129
R-free	0.15530
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3axg
RMSD bond length	0.014
RMSD bond angle	1.807
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.150
High resolution limit [Å]	1.130	1.130
Rmerge	0.055	0.647
Rmeas	0.059	0.703
Number of reflections	240917	11845
<I/σ(I)>	33.9	3.22
Completeness [%]	99.5	98.6
Redundancy	7	6.5
CC(1/2)	0.999	0.904

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	283	1.4 M ammonium sulfate, 0.2 M sodium chloride, 0.1 M HEPES pH 7.5