6LDK

Isoleucyl-tRNA synthetase from Candida albicans complexed with a isoleucyl-adenylate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 11C
Synchrotron site	PAL/PLS
Beamline	11C
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-12-15
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.9795
Spacegroup name	P 1 21 1
Unit cell lengths	56.491, 137.618, 73.752
Unit cell angles	90.00, 106.31, 90.00

Refinement procedure

Resolution	49.340 - 2.900
R-factor	0.1759
Rwork	0.172
R-free	0.23940
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1ile
RMSD bond length	0.009
RMSD bond angle	1.066
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.14_3260)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	49.400	2.950
High resolution limit [Å]	2.900	2.900
Number of reflections	23469	23469
<I/σ(I)>	11.5
Completeness [%]	98.4
Redundancy	4.7
CC(1/2)	0.989	0.459

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	MES, PEG 8000