2OPK

CRYSTAL STRUCTURE OF A PUTATIVE MANNOSE-6-PHOSPHATE ISOMERASE (REUT_A1446) FROM RALSTONIA EUTROPHA JMP134 AT 2.10 A RESOLUTION

Experimental procedure

Experimental method	MAD
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL11-1
Synchrotron site	SSRL
Beamline	BL11-1
Temperature [K]	100
Detector technology	CCD
Collection date	2007-01-07
Detector	MARMOSAIC 325 mm CCD
Wavelength(s)	0.91837, 0.97876, 0.97904
Spacegroup name	P 43 21 2
Unit cell lengths	75.580, 75.580, 198.870
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.410 - 2.100
R-factor	0.168
Rwork	0.166
R-free	0.20700
Structure solution method	MAD
RMSD bond length	0.016
RMSD bond angle	1.656
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	SOLVE
Refinement software	REFMAC (5.2.0005)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	28.410		2.170
High resolution limit [Å]	2.100	3.590	2.100
Rmerge	0.135	0.058	0.534
Number of reflections	34611
<I/σ(I)>	8.69	19.8	2.54
Completeness [%]	99.8	99.2	98.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	8.5	277	NANODROP, 1.5M (NH4)2SO4, 12.0% Glycerol, 0.1M TRIS-HCL, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K