2IST

crystal structure of RluD from E. coli

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL7-1
Synchrotron site	SSRL
Beamline	BL7-1
Temperature [K]	103
Spacegroup name	P 21 21 21
Unit cell lengths	67.320, 75.140, 85.800
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	53.000 - 1.860
R-factor	0.199
Rwork	0.199
R-free	0.24100
Structure solution method	MAD combined with MIR
RMSD bond length	0.017
RMSD bond angle	1.625
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	SOLVE
Refinement software	REFMAC (5.2.0005)

Data quality characteristics

	Overall
Low resolution limit [Å]	53.000
High resolution limit [Å]	1.860
Number of reflections	36440

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.6	298	equal parts protein (~3mg/ml) and precipitant 12-18% PEG 4000, 100 mM Tris, pH 8.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K
1	VAPOR DIFFUSION, HANGING DROP	8.6	298	equal parts protein (~3mg/ml) and precipitant 12-18% PEG 4000, 100 mM Tris, pH 8.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K
1	VAPOR DIFFUSION, HANGING DROP	8.6	298	equal parts protein (~3mg/ml) and precipitant 12-18% PEG 4000, 100 mM Tris, pH 8.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K