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2BMB

X-ray structure of the bifunctional 6-hydroxymethyl-7,8- dihydroxypterin pyrophosphokinase dihydropteroate synthase from Saccharomyces cerevisiae

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RUH3R
Temperature [K]113
Detector technologyIMAGE PLATE
Collection date2003-11-18
DetectorRIGAKU IMAGE PLATE
Spacegroup nameP 41 21 2
Unit cell lengths92.566, 92.566, 192.401
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution40.000 - 2.300
R-factor0.18
Rwork0.178
R-free0.21600
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1eye PDB ENTRY 1CBK
RMSD bond length0.009
RMSD bond angle1.212
Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareMOLREP
Refinement softwareREFMAC (5.2.0005)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]40.0002.340
High resolution limit [Å]2.3002.300
Rmerge0.1700.850
Number of reflections37688
<I/σ(I)>22.43.8
Completeness [%]99.191.1
Redundancy10.72
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
16.51.17 M NAH2PO4, 0.63 M K2HPO4, PH 6.3

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