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1X2T

Crystal Structure of Habu IX-bp at pH 6.5

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2001-08-17
DetectorRIGAKU RAXIS IV
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths60.710, 63.509, 66.902
Unit cell angles90.00, 117.00, 90.00
Refinement procedure
Resolution33.260 - 1.720
Rwork0.191
R-free0.22200
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1bj3
RMSD bond length0.005
RMSD bond angle1.200
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]54.1001.780
High resolution limit [Å]1.7201.720
Rmerge0.0710.173
Number of reflections47809
<I/σ(I)>7.82.6
Completeness [%]99.092.9
Redundancy43.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1MICROBATCH6.5293PEG 1000, PEG 8000, calcium chloride, MES, pH 6.5, MICROBATCH, temperature 293K

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