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3OJ7

Crystal structure of a histidine triad family protein from entamoeba histolytica, bound to sulfate

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsALS BEAMLINE 5.0.3
Synchrotron siteALS
Beamline5.0.3
Temperature [K]100
Detector technologyCCD
Collection date2010-07-31
DetectorADSC QUANTUM 315
Wavelength(s)0.976500
Spacegroup nameC 2 2 21
Unit cell lengths52.890, 61.030, 67.310
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution34.370 - 1.400
R-factor0.163
Rwork0.162
R-free0.18400
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1XQU
RMSD bond length0.015
RMSD bond angle1.697
Data reduction softwareXDS
Data scaling softwareXSCALE
Phasing softwarePHASER
Refinement softwareREFMAC (5.5.0109)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]34.3701.440
High resolution limit [Å]1.4001.400
Rmerge0.0360.495
Number of reflections21768
<I/σ(I)>25.273.8
Completeness [%]99.8100
Redundancy7.037.12
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP4.5289INTERNAL TRACKING 216243A1. JCSG SCREEN CONDITION A1: 50% PEG400, 0.1 M ACETATE BUFFER PH 4.5, 200 MM LI2SO4, ENHIA.01296.A.A1 PS00632 AT 83.2 MG/ML, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 289K

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