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1BIO

HUMAN COMPLEMENT FACTOR D IN COMPLEX WITH ISATOIC ANHYDRIDE INHIBITOR

Experimental procedure
Source typeROTATING ANODE
Source detailsRIGAKU RUH2R
Temperature [K]95
Detector technologyIMAGE PLATE
Collection date1997-01
DetectorRIGAKU RAXIS IV
Spacegroup nameP 1 21 1
Unit cell lengths55.480, 49.910, 39.430
Unit cell angles90.00, 105.69, 90.00
Refinement procedure
Resolution20.000 - 1.500
R-factor0.186
Rwork0.186
R-free0.19100
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1DSU MOLECULE B
RMSD bond length0.009
RMSD bond angle27.570

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Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareX-PLOR (3.851)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0001.550
High resolution limit [Å]1.5001.500
Rmerge0.0510.253
Total number of observations133846

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Number of reflections31552
<I/σ(I)>295.5
Completeness [%]95.090
Redundancy4.14
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

*

6.4drop consists of equal volume of protein and reservoir solutions

*

Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein8-10 (mg/ml)
21dropTris-HCl10 (mM)
31drop0.1 (M)
41dropDMSO-dissolved IAa molar ratio of 20:1
51reservoirPEG600014-16 (%(w/v))
61reservoirMES50 (mM)
71reservoirDMSO10 (%)

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