8IWQ

Pseudomoans Aerugiona Native Ketopantoate Reductase with glycerol

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	BRUKER X8 PROTEUM
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-02-06
Detector	Bruker PHOTON III
Wavelength(s)	1.54
Spacegroup name	P 1 21 1
Unit cell lengths	66.849, 47.497, 96.265
Unit cell angles	90.00, 99.46, 90.00

Refinement procedure

Resolution	26.864 - 2.191
R-factor	0.1981
Rwork	0.195
R-free	0.24220
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.002
RMSD bond angle	0.553
Data reduction software	PROTEUM PLUS
Data scaling software	PROTEUM PLUS
Phasing software	PHASER
Refinement software	PHENIX (1.14)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	27.090	2.270
High resolution limit [Å]	2.190	2.190
Number of reflections	30908	2947
<I/σ(I)>	9.5
Completeness [%]	99.6
Redundancy	5.2
CC(1/2)	0.995	0.703

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		295	l