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1A33

PEPTIDYLPROLYL ISOMERASE, CYCLOPHILIN-LIKE DOMAIN FROM BRUGIA MALAYI

Experimental procedure
Source typeROTATING ANODE
Source detailsENRAF-NONIUS FR591
Temperature [K]95
Detector technologyIMAGE PLATE
Collection date1996-07
DetectorMACSCIENCE
Spacegroup nameP 41 21 2
Unit cell lengths57.900, 57.900, 140.130
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution8.000 - 2.150
R-factor0.169
Rwork0.169
R-free0.21100
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1cwa
RMSD bond length0.012
RMSD bond angle25.750

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Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareX-PLOR (3.851)
Refinement softwareX-PLOR (3.851)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]10.0002.230
High resolution limit [Å]2.1502.150
Rmerge0.0500.080
Total number of observations84704

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Number of reflections13361
<I/σ(I)>3622
Completeness [%]98.698.6

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Redundancy6.46
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

*

619

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THE INITIAL 6 UL DROP CONSISTED OF 50 MM MES-NAOH PH 6.0, 0.9 M (NH4)2SO4, 1MM PROTEIN. THE 1 ML RESERVOIR SOLUTION CONSISTED OF 100 MM MES-NAOH PH 6.0, 1.8 M (NH4)2SO4
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein14 (mg/ml)
21reservoirMES-NaOH100 (mM)
31reservoirammonium sulfate1.8 (M)
41dropMES-NaOH50 (mM)
51dropammonium sulfate0.9 (M)

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