6Y01

The structure of the molybdenum cofactor binding protein from the phototrophic bacterium Rippkaea orientalis

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06DA
Synchrotron site	SLS
Beamline	X06DA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2015-05-17
Detector	DECTRIS PILATUS 2M-F
Wavelength(s)	1.00003
Spacegroup name	P 1 21 1
Unit cell lengths	68.577, 72.044, 70.264
Unit cell angles	90.00, 113.33, 90.00

Refinement procedure

Resolution	64.518 - 1.230
Rwork	0.142
R-free	0.16290
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	2iz6
RMSD bond length	0.019
RMSD bond angle	1.845
Data scaling software	Aimless (0.7.4)
Phasing software	PHASER (2.5.6)
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.520	1.274
High resolution limit [Å]	1.230	1.230
Rmerge	0.053	3.026
Rmeas	0.057	3.299
Rpim	0.022	1.297
Number of reflections	181674	18104
<I/σ(I)>	16.35	0.55
Completeness [%]	100.0	100
Redundancy	6.7	6.3
CC(1/2)	1.000	0.193

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6	292	15% (v/v) Pentaerythritol ethoxylate; 0.2 M potassium acetate; 3% (v/v) Jeffamine T-403; 0.1 M MES pH 6.0