Data quality metrics extracted from 6jq8.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 6JQ8 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
PAL/PLS BEAMLINE 11C
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
PAL/PLS
Beamline
_diffrn_source.pdbx_synchrotron_beamline
11C
Temperature [K]
_diffrn.ambient_temp
100
Detector technology
_diffrn_detector.detector
PIXEL
Collection date
_diffrn_detector.pdbx_collection_date
2018-05-03
Detector
_diffrn_detector.type
DECTRIS PILATUS3 S 6M
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
0.97928
Software
Data reduction
_software.classification
HKL-2000
Data scaling
_software.classification
HKL-2000
Phasing
_software.classification
PHENIX
Refinement
_software.classification
PHENIX (1.13_2998: ???)
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 43
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
80.526 80.526 53.081 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
0.97928 Å

Data quality metricsOverall
Low resolution limit [Å] 
_reflns.d_resolution_low
 44.320
High resolution limit [Å] 
_reflns.d_resolution_high
 1.546
  Rmerge -
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique 
_reflns.number_obs
 49164
<I/σ(I)> 
_reflns.pdbx_netI_over_sigmaI
 43.89
Completeness [%] 
_reflns.percent_possible_obs
 96.2
Multiplicity 
_reflns.pdbx_redundancy
 12.4
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
6JQ8
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2019-03-29
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
44.3 - 1.546 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.2067 / 0.2288