9MQF

Chloroplast acyl-ACP thioesterase from Chlamydomonas reinhardtii

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.2
Synchrotron site	ALS
Beamline	5.0.2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-03-17
Detector	DECTRIS PILATUS3 6M
Wavelength(s)	1.00005
Spacegroup name	P 41 2 2
Unit cell lengths	67.259, 67.259, 207.283
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	48.200 - 2.500
R-factor	0.238
Rwork	0.237
R-free	0.25300
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.003
RMSD bond angle	0.557
Data reduction software	HKL-2000 (0.95)
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.20.1-4487-000)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.200	2.600
High resolution limit [Å]	2.500	2.500
Number of reflections	17356	1873
<I/σ(I)>	28.8
Completeness [%]	100.0	100
Redundancy	24.8
CC(1/2)	1.000	0.903

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7	293.15	3M sodium acetate, 1:2 protein:well solution ratio