4Y9I

Structure of F420-H2 Dependent Reductase (FDR-A) msmeg_2027

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SEALED TUBE
Source details	Xenocs GeniX 3D Cu HF
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2012-11-11
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5418
Spacegroup name	I 1 2 1
Unit cell lengths	37.490, 36.850, 77.591
Unit cell angles	90.00, 96.59, 90.00

Refinement procedure

Resolution	26.195 - 1.498
R-factor	0.1571
Rwork	0.155
R-free	0.19860
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3r5z
RMSD bond length	0.020
RMSD bond angle	1.909
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	PHENIX ((phenix.refine: 1.9_1692))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	26.195	1.520
High resolution limit [Å]	1.498	1.498
Rmerge	0.062	0.514
Number of reflections	16332
<I/σ(I)>	13	2.1
Completeness [%]	95.6	92.1
Redundancy	2.7	2.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6.7	291.15	20% PEGMME5000, 0.05 M imidazole