5FCZ

Streptomyces plicatus N-acetyl-beta-hexosaminidase in complex with Thio-NAglucal (TNX)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007 HF
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2015-05-21
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	P 61 2 2
Unit cell lengths	133.870, 133.870, 174.913
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	53.154 - 2.450
R-factor	0.1578
Rwork	0.154
R-free	0.20990
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1hp4
RMSD bond length	0.012
RMSD bond angle	1.162
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((dev_2236))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	62.510	2.550
High resolution limit [Å]	2.450	2.450
Rmerge	0.135	0.544
Number of reflections	33484
<I/σ(I)>	12.4	3.4
Completeness [%]	96.7	96
Redundancy	9	8.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	293.15	1.8M ammonium sulphate, 0.1M trisodium citrate pH 6.0