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1QJJ

Structure of astacin with a hydroxamic acid inhibitor

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeROTATING ANODE
Source detailsRIGAKU RUH2R
Temperature [K]289
Detector technologyAREA DETECTOR
Collection date1994-05-15
DetectorBRUKER NONIUS FAST
Spacegroup nameP 31 2 1
Unit cell lengths61.900, 61.900, 98.700
Unit cell angles90.00, 90.00, 120.00
Refinement procedure
Resolution8.000 - 1.860
R-factor0.161
Rwork0.161
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)1ast
RMSD bond length0.011
RMSD bond angle1.500
Data reduction softwareMADNESS
Data scaling softwarePROTEIN
Phasing softwareX-PLOR
Refinement softwareX-PLOR
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]8.0001.900
High resolution limit [Å]1.8601.860
Rmerge0.082
Number of reflections16311
Completeness [%]67.835.5
Redundancy2.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1unknown

*

7This particular structure is not described in this paper.

*

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