6C4K

Full length hUGDH with A104L substitution in the absence of ligand

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-BM
Synchrotron site	APS
Beamline	22-BM
Temperature [K]	80
Detector technology	CCD
Collection date	2017-06-21
Detector	MARRESEARCH
Wavelength(s)	1.0
Spacegroup name	C 1 2 1
Unit cell lengths	178.520, 114.470, 96.880
Unit cell angles	90.00, 116.50, 90.00

Refinement procedure

Resolution	48.161 - 2.650
R-factor	0.2232
Rwork	0.222
R-free	0.25500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4rjt
RMSD bond length	0.002
RMSD bond angle	0.429
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX ((1.12_2829: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.161	2.712
High resolution limit [Å]	2.650	2.650
Number of reflections	50717
<I/σ(I)>	13.73
Completeness [%]	99.7
Redundancy	7.7

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.6	293	16% PEG 3350, 0.5M NaCl, 0.1M Tris (pH 7.6)