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1P84

HDBT inhibited Yeast Cytochrome bc1 Complex

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsESRF BEAMLINE ID14-3
Synchrotron siteESRF
BeamlineID14-3
Temperature [K]277
Detector technologyCCD
Collection date2000-12-04
DetectorMARRESEARCH
Spacegroup nameC 1 2 1
Unit cell lengths214.998, 165.091, 147.525
Unit cell angles90.00, 117.33, 90.00
Refinement procedure
Resolution25.000 - 2.500
Rwork0.228
R-free0.25200
Structure solution methodPositional and B-factor refinement
Starting model (for MR)1kb9 protein only
RMSD bond length0.007

*

RMSD bond angle1.298

*

Data reduction softwareDENZO
Data scaling softwareSCALEPACK
Refinement softwareCNS (1.0)
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]25.0002.560
High resolution limit [Å]2.5002.500
Rmerge0.0660.373

*

Total number of observations372220

*

Number of reflections1491039128

*

<I/σ(I)>13.41.2
Completeness [%]92.484.6
Redundancy2.5
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1Vapor diffusion

*

7.54

*

PEG4000, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 277K
Crystallization Reagents in Literatures
IDcrystal IDsolutionreagent nameconcentration (unit)details
11dropprotein50 (mg/ml)
21reservoirPEG40005 (%)pH7.5
31reservoirn-undecyl-beta-D-maltopyranoside0.05 (%)
41reservoirHHDBT10000 (nM)pH8.0
51reservoirTris-HCl

218853

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