6C1E

NavAb NormoPP mutant

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.1
Synchrotron site	ALS
Beamline	8.2.1
Temperature [K]	100
Detector technology	CCD
Collection date	2014-10-11
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	0.99994
Spacegroup name	I 2 2 2
Unit cell lengths	126.775, 126.997, 192.287
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.500 - 2.860
R-factor	0.2139
Rwork	0.212
R-free	0.23990
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3rvy
RMSD bond length	0.010
RMSD bond angle	1.310
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	AutoSol
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	42.500	3.000
High resolution limit [Å]	2.860	2.860
Number of reflections	35059
<I/σ(I)>	16.6
Completeness [%]	100.0
Redundancy	7.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION		277	ammonium sulphate, Na-citrate