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1Y20

Crystal structure of the NR1 ligand-binding core in complex with ACPC

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X4A
Synchrotron siteNSLS
BeamlineX4A
Temperature [K]110
Detector technologyCCD
Collection date2004-02-19
DetectorADSC QUANTUM 4
Wavelength(s)0.9795
Spacegroup nameP 21 21 21
Unit cell lengths41.393, 72.634, 96.263
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution14.960 - 1.400
R-factor0.201
Rwork0.199
R-free0.22000
Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.005
RMSD bond angle1.300
Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareCNS (1.1)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]29.4001.450
High resolution limit [Å]1.4001.400
Rmerge0.0870.330
Number of reflections56029
<I/σ(I)>203.6
Completeness [%]96.6100
Redundancy5.34.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6277PEG, pH 6., VAPOR DIFFUSION, HANGING DROP, temperature 277K

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