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1KW8

Crystal structure of BphC-2,3-dihydroxybiphenyl-NO complex

Replaces:  1GDG
Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsPHOTON FACTORY BEAMLINE BL-6A
Synchrotron sitePhoton Factory
BeamlineBL-6A
Temperature [K]100
Detector technologyCCD
Collection date2000-02-05
DetectorADSC QUANTUM 4
Wavelength(s)1.0
Spacegroup nameI 4 2 2
Unit cell lengths121.720, 121.720, 109.008
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution87.700

*

- 2.000
R-factor0.16221
Rwork0.161
R-free0.18400

*

Structure solution methodMOLECULAR REPLACEMENT
RMSD bond length0.009
RMSD bond angle1.290

*

Data reduction softwareMOSFLM
Data scaling softwareSCALA
Phasing softwareAMoRE
Refinement softwareREFMAC (5.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]87.700

*

2.110
High resolution limit [Å]2.0002.000
Rmerge0.0830.324
Number of reflections27911
<I/σ(I)>7.1
Completeness [%]99.9100
Redundancy14.113.4
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Batch method

*

7.512

*

Uragami, Y., (2001) J.Inorg.Biochem., 83, 269.

*

Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
111protein10 (mg/ml)
211Tris-HCl100 (mM)
311ammonium sulfate27.7 (%sat)
411hexylene glycol18 (%(v/v))

218196

건을2024-04-10부터공개중

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