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1HSO

HUMAN ALPHA ALCOHOL DEHYDROGENASE (ADH1A)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]110
Detector technologyIMAGE PLATE
Collection date1996-02-28
DetectorRIGAKU RAXIS IIC
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths55.700, 100.200, 69.100
Unit cell angles90.00, 104.90, 90.00
Refinement procedure
Resolution44.000 - 2.500
R-factor0.194
Rwork0.248
R-free0.19100
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1deh
RMSD bond length0.008
RMSD bond angle1.320

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareX-PLOR (3.851)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]44.0002.590
High resolution limit [Å]2.5002.500
Rmerge0.0920.294
Total number of observations48374

*

Number of reflections23704
<I/σ(I)>10.53.2
Completeness [%]92.983
Redundancy2.051.75
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1unknown

*

7.224

*

14% (w/v) PEG 6000, 100 mM ACES, 2mM NAD+, 2mM 4-iodopyrazole, 10 mg/ml protein, pH 7.2, VAPOR DIFFUSION, SITTING DROP at 298K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
111PEG600014 (%)
211Na-ACES100 (mM)
311NAD+2 (mM)
4114-iodopyrazole2 (mM)
511protein10 (mg/ml)

217705

PDB entries from 2024-03-27

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