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7YOD

Crystal structure of A68P single mutant of O-acetylserine sulfhydrylase from Haemophilus influenzae in complex with high-affinity inhibitory peptide from serine acetyltransferase of Salmonella typhimurium at 2.1 A

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU
Temperature [K]293
Detector technologyIMAGE PLATE
Collection date2012-05-26
DetectorMAR scanner 345 mm plate
Wavelength(s)1.54179
Spacegroup nameI 41
Unit cell lengths112.599, 112.599, 45.822
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution39.810 - 2.101
Rwork0.222
R-free0.25530
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1y7l
RMSD bond length0.007
RMSD bond angle1.519
Data reduction softwareHKL-2000
Data scaling softwareSCALA
Phasing softwarePHASER
Refinement softwareREFMAC (5.8.0267)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]39.8102.176
High resolution limit [Å]2.1012.101
Number of reflections169691671
<I/σ(I)>37.22
Completeness [%]100.0
Redundancy1.1
CC(1/2)1.0001.000
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.42780.1M HEPES, 1.3M Sodium citrate

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