3NOL

Crystal structure of Zymomonas mobilis Glutaminyl Cyclase (trigonal form)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU MICROMAX-007
Detector technology	IMAGE PLATE
Collection date	2007-09-25
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.5418
Spacegroup name	P 31 2 1
Unit cell lengths	61.423, 61.423, 98.800
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	22.460 - 1.700
R-factor	0.1798
Rwork	0.178
R-free	0.22020
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2iwa
RMSD bond length	0.013
RMSD bond angle	1.395
Data reduction software	MOSFLM
Data scaling software	SCALA (3.2.25)
Phasing software	PHASER (1.3.3)
Refinement software	REFMAC

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	53.225	22.462	1.790
High resolution limit [Å]	1.700	5.380	1.700
Rmerge	0.086	0.040	0.536
Rmeas		0.042	0.574
Rpim		0.015	0.201
Total number of observations		6842	27975
Number of reflections	24365
<I/σ(I)>	21	52.1	3.5
Completeness [%]	99.9	98.4	100
Redundancy	8.4	8.2	8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1