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1ISP

Crystal structure of Bacillus subtilis lipase at 1.3A resolution

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-6A
Synchrotron sitePhoton Factory
BeamlineBL-6A
Temperature [K]100
Detector technologyCCD
Collection date2000-11-07
DetectorADSC QUAMTUM 4r
Wavelength(s)1.000
Spacegroup nameP 21 21 21
Unit cell lengths38.200, 58.450, 82.290
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution20.000 - 1.300
Rwork0.192
R-free0.23200
Structure solution methodMAD
RMSD bond length0.029
RMSD bond angle2.360

*

Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareSOLVE
Refinement softwareSHELXL-97
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]20.0001.370
High resolution limit [Å]1.3001.300
Rmerge0.0680.315
Total number of observations169453

*

Number of reflections44447
<I/σ(I)>6.52.2
Completeness [%]96.579.9
Redundancy3.83.1
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, HANGING DROP7.5

*

293PEG 8000, glycerol, pH 8.7, VAPOR DIFFUSION, HANGING DROP, temperature 293K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11reservoirTris-HCl100 (mM)pH8.7-8.8
21reservoirPEG80006-9 (%(w/v))
31reservoirglycerol17 (%(v/v))
41dropTris-HCl20 (mM)pH7.5
51dropprotein15 (mg/ml)

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