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1EZQ

CRYSTAL STRUCTURE OF HUMAN COAGULATION FACTOR XA COMPLEXED WITH RPR128515

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsLURE BEAMLINE DW32
Synchrotron siteLURE
BeamlineDW32
Temperature [K]95
Detector technologyIMAGE PLATE
Collection date1998-04-30
DetectorMARRESEARCH
Spacegroup nameP 21 21 21
Unit cell lengths56.196, 71.922, 78.587
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 2.200
R-factor0.208
Rwork0.208
R-free0.26700
RMSD bond length0.007
RMSD bond angle1.300
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareX-PLOR (3.851)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0002.280
High resolution limit [Å]2.2002.200
Rmerge0.0610.236
Number of reflections15689
<I/σ(I)>12.1
Completeness [%]93.991.8
Redundancy2.72.52
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP6

*

19

*

18-20% PEG 600, 50mM Mes-NaOH, 1mM RPR128515, pH 5.7, VAPOR DIFFUSION, HANGING DROP, temperature 292K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein8 (mg/ml)
21dropMES-NaOH5 (mM)
31drop5 (mM)
41dropunit0.001 (mM)
51reservoirPEG60018-20 (%)
61reservoirMES- NaOH50 (mM)

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