2OI7

E. coli GlmU- Complex with UDP-GlcNAc, desulpho-CoA and GlcNAc-1-PO4

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	125
Detector technology	IMAGE PLATE
Collection date	2001-10-15
Detector	RIGAKU RAXIS IV
Spacegroup name	H 3 2
Unit cell lengths	102.969, 102.969, 644.076
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	27.450 - 2.540
R-factor	0.209
Rwork	0.209
R-free	0.24700
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1hv9
RMSD bond length	0.016
RMSD bond angle	1.400
Data reduction software	DENZO
Data scaling software	SCALEPACK
Phasing software	CNS
Refinement software	CNS (1.0)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.450	2.630
High resolution limit [Å]	2.540	2.540
Rmerge	0.072	0.147
Number of reflections	41785
Completeness [%]	94.3	82.1
Redundancy	5.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.6	298	Tris, NaCl, DTT, azide, MgCl2, desulpho-CoA, GlcNAc-1-PO4,UDP-GlcNAc, ammonium sulfate, CoCl2 , pH 5.6, VAPOR DIFFUSION, HANGING DROP, temperature 298K