6MKA

Crystal structure of penicillin binding protein 5 (PBP5) from Enterococcus faecium in the open conformation

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2016-06-23
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97946
Spacegroup name	P 63 2 2
Unit cell lengths	190.540, 190.540, 156.467
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	39.503 - 2.698
R-factor	0.1807
Rwork	0.179
R-free	0.20600
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5dvy
RMSD bond length	0.006
RMSD bond angle	0.743
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	39.500	2.790
High resolution limit [Å]	2.700	2.700
Rmerge	0.059	0.445
Rmeas	0.080	0.613
Rpim	0.054	0.419
Number of reflections	45763	4382
<I/σ(I)>	13	2.5
Completeness [%]	98.6	97.6
Redundancy	3.1	3.2
CC(1/2)	0.997	0.707

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.5	294	0.1 M trisodium citrate, 2M ammonium sulfate