1UXO

The crystal structure of the ydeN gene product from B. subtilis

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Collection date	2003-10-15
Wavelength(s)	0.97920,0.97931,0.97546
Spacegroup name	P 21 21 21
Unit cell lengths	36.128, 53.971, 93.151
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.620 - 1.800
Rwork	0.125
R-free	0.18100
Structure solution method	OTHER
RMSD bond length	0.019
RMSD bond angle	1.621
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	SHELXD
Refinement software	REFMAC (5.1.24)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.910
High resolution limit [Å]	1.700	1.830
Rmerge	0.082	0.220
Number of reflections	31784
<I/σ(I)>	13.9	4.3
Completeness [%]	99.8	65.8
Redundancy	3.5	2.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	4.6		20% PEG 8000, 0.05 M KH2PO4, PH 4.6