6OVL

2.1 Angstrom structure of wild type Glyoxylate/Hydroxypyruvate reductase A from Escherichia Coli in complex with glyoxylate and NADP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-F
Synchrotron site	APS
Beamline	21-ID-F
Temperature [K]	100
Detector technology	CCD
Collection date	2017-03-18
Detector	MARMOSAIC 300 mm CCD
Wavelength(s)	0.97856
Spacegroup name	P 65 2 2
Unit cell lengths	158.820, 158.820, 96.710
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	36.730 - 2.100
R-factor	0.1646
Rwork	0.164
R-free	0.18380
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3kbo
RMSD bond length	0.003
RMSD bond angle	0.698
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	36.730	2.175
High resolution limit [Å]	2.100	2.100
Number of reflections	41974	3924
<I/σ(I)>	26.2
Completeness [%]	99.1
Redundancy	16.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.6	298	1.4 M sodium phosphate monobasic/ potassium phosphate dibasic, 5 mM NADP, 100 mM sodium glyoxylate