8IQ7

Ambient Temperature Crystal Structure of Candida boidinii Formate Dehydrogenase

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU PhotonJet-R
Temperature [K]	298
Detector technology	PIXEL
Collection date	2023-02-28
Detector	RIGAKU HyPix-3000
Wavelength(s)	1.54
Spacegroup name	P 1
Unit cell lengths	54.668, 69.509, 110.800
Unit cell angles	77.86, 89.05, 81.20

Refinement procedure

Resolution	30.700 - 2.100
R-factor	0.2441
Rwork	0.243
R-free	0.27160
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	8hty
RMSD bond length	0.002
RMSD bond angle	0.545
Data reduction software	CrysalisPro
Data scaling software	CrysalisPro
Phasing software	PHASER
Refinement software	PHENIX ((1.19.2_4158: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.700	2.150
High resolution limit [Å]	2.100	2.100
Rpim	0.106	0.481
Number of reflections	67168	4847
<I/σ(I)>	7.9	0.6
Completeness [%]	85.9
Redundancy	7.5
CC(1/2)	0.916	0.074

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	6.5	277	30% (w/v) PEG 5000 MME, 100 mM MES/Sodium hydroxide pH 6.5, 200 mM Ammonium sulfate