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4C1R

Bacteroides thetaiotaomicron VPI-5482 mannosyl-6-phosphatase Bt3783

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsCLSI BEAMLINE 08ID-1
Synchrotron siteCLSI
Beamline08ID-1
Temperature [K]100
Detector technologyCCD
Collection date2013-03-06
DetectorMARRESEARCH MX-300HE
Spacegroup nameP 1 21 1
Unit cell lengths65.440, 148.810, 71.450
Unit cell angles90.00, 117.10, 90.00
Refinement procedure
Resolution39.150 - 2.100
R-factor0.1582
Rwork0.156
R-free0.20495
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3mpr
RMSD bond length0.013
RMSD bond angle1.529
Data reduction softwareAutoProcess
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.7.0032)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0002.210
High resolution limit [Å]2.1002.100
Rmerge0.1200.440
Number of reflections70728
<I/σ(I)>7.83.3
Completeness [%]99.9100
Redundancy3.63.6
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
18BT3783 CRYSTALS WERE OBTAINED BY MIXING EQUAL VOLUMES OF PURIFIED, RECOMBINANT BT3783 PROTEIN AT A CONCENTRATION OF 11.25 MG PER ML WITH MOTHER LIQUOR SOLUTION CONSISTING OF 15% (W/V) POLYTHEYLENE GLYCOL 4,000, 5% MPD (V PER V), 3 MM D-MANNOSE, AND 200 MM MGCL2., pH 8.0

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