Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

5M2G

PCE reductive dehalogenase from S. multivorans in complex with 2,4,6-tribromophenol

Experimental procedure
Experimental methodSINGLE WAVELENGTH
Source typeSYNCHROTRON
Source detailsBESSY BEAMLINE 14.1
Synchrotron siteBESSY
Beamline14.1
Temperature [K]100
Detector technologyPIXEL
Collection date2014-12-13
DetectorDECTRIS PILATUS 6M
Wavelength(s)0.91841
Spacegroup nameP 41
Unit cell lengths73.610, 73.610, 184.958
Unit cell angles90.00, 90.00, 90.00
Refinement procedure
Resolution47.265 - 1.800
R-factor0.1359
Rwork0.134
R-free0.16670
Structure solution methodMOLECULAR REPLACEMENT
Starting model (for MR)4uqu
RMSD bond length0.010
RMSD bond angle0.994
Data reduction softwareXDS
Data scaling softwareXDS
Phasing softwarePHENIX
Refinement softwarePHENIX ((1.10.1_2155: ???))
Data quality characteristics
 OverallOuter shell
Low resolution limit [Å]47.2651.864
High resolution limit [Å]1.8001.800
Rmerge0.0720.711
Number of reflections90629
<I/σ(I)>15.142.05
Completeness [%]100.0100
Redundancy4.64.7
CC(1/2)0.9980.702
Crystallization Conditions
crystal IDmethodpHtemperaturedetails
1VAPOR DIFFUSION, SITTING DROP7.529115 percent PEG 3350, 200 mM sodium malonate, 2 percent benzamidineHCl, and 50 mM TrisHCl, pH 7.5 under an atmosphere of 95 percent N2, 5 percent H2 and less than 10 ppm oxygen

217705

PDB entries from 2024-03-27

PDB statisticsPDBj update infoContact PDBjnumon