5YWI

Crystal structure of Arabidopsis thaliana HPPD Truncated mutant complexed with NTBC

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U1
Synchrotron site	SSRF
Beamline	BL17U1
Temperature [K]	100
Detector technology	CCD
Collection date	2017-05-01
Detector	ADSC QUANTUM 315r
Wavelength(s)	0.97915
Spacegroup name	C 1 2 1
Unit cell lengths	77.601, 83.568, 64.150
Unit cell angles	90.00, 102.22, 90.00

Refinement procedure

Resolution	29.776 - 2.580
R-factor	0.2553
Rwork	0.254
R-free	0.28720
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1tfz
RMSD bond length	0.009
RMSD bond angle	0.713
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.13_2998: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.640
High resolution limit [Å]	2.580	2.580
Rmerge	0.059	0.432
Rmeas	0.073	0.537
Rpim	0.043	0.314
Number of reflections	11361	504
<I/σ(I)>	20.36	1.54
Completeness [%]	90.5
Redundancy	2.6	2.4
CC(1/2)		0.873

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291.16	0.1M Tris-HCl-Bicine pH8.5, 12.5% MPD, 12.5% PEG 1000, 12.5% PEG 3350, 0.03M NaF, 0.03M NaBr, 0.03M NaI