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1PJP

THE 2.2 A CRYSTAL STRUCTURE OF HUMAN CHYMASE IN COMPLEX WITH SUCCINYL-ALA-ALA-PRO-PHE-CHLOROMETHYLKETONE

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RU200
Temperature [K]301
Detector technologyIMAGE PLATE
DetectorMARRESEARCH
Spacegroup nameP 43
Unit cell lengths74.370, 74.370, 50.090
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution8.000 - 2.200
R-factor0.184
Rwork0.184
R-free0.23700
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)3rp2
RMSD bond length0.008
RMSD bond angle24.810

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Phasing softwareAMoRE
Refinement softwareX-PLOR (3.851)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0002.260
High resolution limit [Å]2.2002.200
Rmerge0.0760.254
Total number of observations138168

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Number of reflections14122
Completeness [%]96.498.8
Redundancy9.78
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion, hanging drop

*

6.8

*

22

*

pH 7.5
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropMOPS10 (mM)pH6.8
21drop50 (mM)
31dropprotein7.6 (mg/ml)
41reservoirHEPES100 (mM)pH7.5
51reservoirPEG1000020 (%(v/v))

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PDB entries from 2024-10-09

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