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1FCZ

ISOTYPE SELECTIVITY OF THE HUMAN RETINOIC ACID NUCLEAR RECEPTOR HRAR: THE COMPLEX WITH THE PANAGONIST RETINOID BMS181156

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsEMBL/DESY, HAMBURG BEAMLINE BW7B
Synchrotron siteEMBL/DESY, HAMBURG
BeamlineBW7B
Temperature [K]100
Detector technologyIMAGE PLATE
Collection date1998-07-12
DetectorMARRESEARCH
Spacegroup nameP 41 21 2
Unit cell lengths59.884, 59.884, 155.805
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution6.000 - 1.380
R-factor0.1314
Rwork0.131
R-free0.17380
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1fcy
RMSD bond length0.013
RMSD bond angle2.310

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareSHELXL-97
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0001.400
High resolution limit [Å]1.3801.380
Rmerge0.0480.350
Total number of observations299978

*

Number of reflections59216
<I/σ(I)>35.54.15
Completeness [%]99.899.8
Redundancy5.074.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP717

*

sodium acetate, pH 7.0, VAPOR DIFFUSION, HANGING DROP at 290K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoirPIPES0.1 (M)
21reservoir0.2-1.7 (M)
31dropprotein2-5 (mg/ml)
41dropTris-HCl10 (mM)
51drop1,4-dithio-DL-threitol5 (mM)
61drop500 (mM)
71dropn-dodecyl-alpha-D-maltoside0.15 (mM)
81dropCHAPS2 (mM)
91dropglycerol4 (%)

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