5NLZ

GRIFIN (Crystallisation pH: 4.2)

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALBA BEAMLINE XALOC
Synchrotron site	ALBA
Beamline	XALOC
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-05-20
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.149
Spacegroup name	P 1 21 1
Unit cell lengths	39.093, 60.830, 53.999
Unit cell angles	90.00, 92.57, 90.00

Refinement procedure

Resolution	39.054 - 1.149
R-factor	0.1391
Rwork	0.138
R-free	0.16460
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5nld
RMSD bond length	0.008
RMSD bond angle	1.041
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHENIX
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.054	1.190
High resolution limit [Å]	1.149	1.149
Rmerge	0.024	0.280
Number of reflections	85844	7759
<I/σ(I)>	12.53	2.14
Completeness [%]	95.6	86.82
Redundancy	1.6	1.4
CC(1/2)	0.990	0.820

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.2	295	Crystallization condition 20% PEG 8K, 0.1M phosphate-citrate pH 4.2, 0.2M NaCl