5ZQE

Crystal Structure of Penicillin-Binding Protein D2 from Listeria monocytogenes in the Cefuroxime bound form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	200
Detector technology	CCD
Collection date	2016-07-23
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.9794
Spacegroup name	P 1 21 1
Unit cell lengths	75.041, 99.258, 155.050
Unit cell angles	90.00, 103.93, 90.00

Refinement procedure

Resolution	29.982 - 1.996
R-factor	0.2037
Rwork	0.199
R-free	0.23620
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5zqa
RMSD bond length	0.006
RMSD bond angle	0.821
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.982	2.067
High resolution limit [Å]	1.996	1.996
Number of reflections	149025	14478
<I/σ(I)>	11.7
Completeness [%]	91.1	84.24
Redundancy	6.1	5.9

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	295