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1M6T

CRYSTAL STRUCTURE OF B562RIL, A REDESIGNED FOUR HELIX BUNDLE

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsNSLS BEAMLINE X9B
Synchrotron siteNSLS
BeamlineX9B
Temperature [K]100
Detector technologyCCD
Collection date2000-02-02
DetectorADSC QUANTUM 4
Wavelength(s)1.0090
Spacegroup nameC 2 2 21
Unit cell lengths41.300, 52.340, 93.800
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution18.900 - 1.800

*

Rwork0.210
R-free0.24800
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)256b
RMSD bond length0.005
RMSD bond angle17.100

*

Data reduction softwareHKL-2000
Data scaling softwareSCALEPACK
Phasing softwareCNS
Refinement softwareCNS
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]18.9001.860
High resolution limit [Å]1.800

*

1.810
Rmerge0.039

*

0.533
Number of reflections9252
<I/σ(I)>46.12.9
Completeness [%]97.4

*

76.8
Redundancy5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP8

*

2983.2 M NH4(SO4), 2.44 mM N-octanoylsucrose, 0.1 M Bicine, pH 9.0, VAPOR DIFFUSION, SITTING DROP, temperature 298K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein24 (mg/ml)
21dropTris-HCl20 (mM)pH8.0
31dropN-octanoylsucrose2.44 (mM)
41reservoirammonium sulfate3.2 (M)
51reservoirBicine0.1 (M)pH9.0

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PDB entries from 2024-09-18

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