4LZJ

Crystal Structure of MurQ from H.influenzae with bound inhibitor

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	298
Detector technology	IMAGE PLATE
Wavelength(s)	1.5418
Spacegroup name	P 2 21 21
Unit cell lengths	76.492, 113.335, 143.917
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	44.520 - 2.405
R-factor	0.1687
Rwork	0.166
R-free	0.22510
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1nri
RMSD bond length	0.008
RMSD bond angle	1.197
Data reduction software	HKL-3000
Data scaling software	HKL-3000
Phasing software	PHENIX
Refinement software	PHENIX ((phenix.refine: 1.8.1_1168))

Data quality characteristics

	Overall
Low resolution limit [Å]	42.520
High resolution limit [Å]	2.400
Number of reflections	48045

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	298	0.2 M NaCl, 0.1 M Bis-Tris:HCl, pH 5.5, 25% (w/v) PEG-3350, VAPOR DIFFUSION, SITTING DROP, temperature 298.0K