5ZNT

Insect chitin deacetylase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2016-10-17
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97776
Spacegroup name	I 4
Unit cell lengths	136.006, 136.006, 77.209
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.085 - 1.979
R-factor	0.1683
Rwork	0.167
R-free	0.19070
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5zns
RMSD bond length	0.010
RMSD bond angle	0.994
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.11_2567: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.010
High resolution limit [Å]	1.979	1.979
Number of reflections	49155	2407
<I/σ(I)>	4.3
Completeness [%]	100.0
Redundancy	13.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		281	0.2M Sodium malonate pH 7.0, 20% w/v Polyethylene glycol 3350