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7C0K

Crystal structure of a dinucleotide-binding protein of ABC transporter endogenously bound to uridylyl-3'-5'-phospho-guanosine (Form II)

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU MICROMAX-007 HF
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date2017-04-13
DetectorRIGAKU RAXIS IV++
Wavelength(s)1.5418
Spacegroup nameP 1 21 1
Unit cell lengths66.170, 57.520, 121.140
Unit cell angles90.00, 94.99, 90.00
Refinement procedure
Resolution46.570 - 1.800
R-factor0.1475
Rwork0.146
R-free0.17620
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)7c0f
RMSD bond length0.018
RMSD bond angle2.120
Data reduction softwareMOSFLM (7.2.2)
Data scaling softwareAimless (0.7.4)
Phasing softwarePHASER (2.8.3)
Refinement softwareREFMAC (5.8.0258)
Data quality characteristics
 OverallInner shellOuter shell
Low resolution limit [Å]46.57046.5701.830
High resolution limit [Å]1.8009.5201.800
Rmerge0.0750.0340.539
Rmeas0.0860.0390.619
Rpim0.0410.0180.301
Total number of observations361385
Number of reflections843146144443
<I/σ(I)>12.3
Completeness [%]99.999.399.6
Redundancy4.34.24.2
CC(1/2)0.9980.9990.792
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6.52770.2M ammonium phosphate, 0.1M sodium cacodylate pH6.5, 30% PEG 8000

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