6JJQ

Crystal structure of peptidyl-tRNA hydrolase from Acinetobacter baumannii at 0.99 A resolution.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-12-01
Detector	PSI PILATUS 6M
Wavelength(s)	0.97201
Spacegroup name	P 21 21 21
Unit cell lengths	34.139, 65.976, 76.011
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.830 - 0.990
R-factor	0.12993
Rwork	0.130
R-free	0.13932
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5y9a
RMSD bond length	0.021
RMSD bond angle	2.096
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0238)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.830	1.010
High resolution limit [Å]	0.990	0.990
Rmerge	0.059	2.300
Rmeas	0.063	2.890
Rpim	0.025	1.710
Number of reflections	86816	5381
<I/σ(I)>	9.8	0.4
Completeness [%]	92.0	29.3
Redundancy	5.64
CC(1/2)	0.990	0.110

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.5	298	HEPES, PEG 1500, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 298 K