4YJI

The Crystal Structure of a Bacterial Aryl Acylamidase Belonging to the Amidase signature (AS) enzymes family

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2014-05-22
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.979
Spacegroup name	P 41 21 2
Unit cell lengths	75.980, 75.980, 214.710
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.970 - 1.730
R-factor	0.1672
Rwork	0.167
R-free	0.18800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4yj6
RMSD bond length	0.007
RMSD bond angle	1.080
Data reduction software	MOSFLM
Data scaling software	MOSFLM
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: 1.8.4_1496))

Data quality characteristics

	Overall
Low resolution limit [Å]	43.840
High resolution limit [Å]	1.730
Number of reflections	65840
<I/σ(I)>	11.5
Completeness [%]	98.6
Redundancy	26.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295.15	1.2 M NaH2PO4/0.8 M K2HPO4, 0.1 M CAPS pH 10.5, 0.2 M Li2SO4 and 0.1 M ZnCl2