6JKW

Seleno-methionine PNGM-1 from deep-sea sediment metagenome

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2013-05-08
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97940
Spacegroup name	P 1 21 1
Unit cell lengths	121.857, 83.124, 162.833
Unit cell angles	90.00, 110.18, 90.00

Refinement procedure

Resolution	34.930 - 2.290
R-factor	0.2143
Rwork	0.211
R-free	0.27420
Structure solution method	MAD
RMSD bond length	0.016
RMSD bond angle	1.725
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	REFMAC (5.7.0029)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	34.930	2.340
High resolution limit [Å]	2.290	2.300
Number of reflections	137843
<I/σ(I)>	4.7
Completeness [%]	98.1
Redundancy	3.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	7	287	0.1M Tris-HCl, 0.2M MgCl2 and 10% PEG 8000