Data quality metrics extracted from 4o9y.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary and a MXLIMS-compatible JSON representation.


Experimental information for 4O9Y at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Experimental protocol
_diffrn_radiation.pdbx_diffrn_protocol
SINGLE WAVELENGTH
Source type
_diffrn_source.source
SYNCHROTRON
Source details
_diffrn_source.type
SLS BEAMLINE X10SA
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
SLS
Beamline
_diffrn_source.pdbx_synchrotron_beamline
X10SA
Temperature [K]
_diffrn.ambient_temp
100
Detector technology
_diffrn_detector.detector
PIXEL
Collection date
_diffrn_detector.pdbx_collection_date
2012-05-04
Detector
_diffrn_detector.type
DECTRIS PILATUS 6M
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
0.97939
Software
Data collection
_software.classification
HKL-2000
Data reduction
_software.classification
MOSFLM
Data scaling
_software.classification
SCALA (3.3.21; 2013/01/04; Phil R. Evans; pre@mrc-lmb.cam.ac.uk)
Phasing
_software.classification
PHENIX
Refinement
_software.classification
PHENIX (1.8.1_1168; Paul D. Adams; PDAdams@lbl.gov)
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 21 21 21
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
303.25 320.73 667.62 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
0.97939 Å

Data quality metricsOverall
Low resolution limit [Å]
_reflns.d_resolution_low
73.112
High resolution limit [Å]
_reflns.d_resolution_high
3.502
Rmerge
_reflns.pdbx_Rsym_value
0.387
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique
_reflns.number_obs
628863
<I/σ(I)>
_reflns.pdbx_netI_over_sigmaI
6.00
Completeness [%]
_reflns.percent_possible_obs
99.7
Multiplicity
_reflns.pdbx_redundancy
8.9
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
4O9Y
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2014-01-03
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
20.0 - 3.502 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.2426 / 0.2950