Data quality metrics extracted from 7jor.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 7JOR at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
NEUTRON DIFFRACTION
Experimental protocol
_diffrn_radiation.pdbx_diffrn_protocol
LAUE
Source type
_diffrn_source.source
NUCLEAR REACTOR
Source details
_diffrn_source.type
ORNL High Flux Isotope Reactor BEAMLINE CG4D
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
ORNL High Flux Isotope Reactor
Beamline
_diffrn_source.pdbx_synchrotron_beamline
CG4D
Temperature [K]
_diffrn.ambient_temp
298
Detector technology
_diffrn_detector.detector
IMAGE PLATE
Collection date
_diffrn_detector.pdbx_collection_date
2016-07-07
Detector
_diffrn_detector.type
MAATEL IMAGINE
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
2-4.5
Software
Data reduction
_software.classification
LAUEGEN
Data scaling
_software.classification
SCALA (v1.0)
Phasing
_software.classification
PHASER (v1.0)
Refinement
_software.classification
PHENIX (v1.0)
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}
60.444 66.120 68.377 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
2.000004.50000 Å

Data quality metricsOverall
Low resolution limit [Å] 
_reflns.d_resolution_low
 17.230
High resolution limit [Å] 
_reflns.d_resolution_high
 1.950
  Rmerge -
  Rmeas -
Rpim 
_reflns.pdbx_Rpim_I_all
 0.118
  Total number of observations -
Total number unique 
_reflns.number_obs
 15930
<I/σ(I)> 
_reflns.pdbx_netI_over_sigmaI
 4.80
Completeness [%] 
_reflns.percent_possible_obs
 79.2
Multiplicity 
_reflns.pdbx_redundancy
 5.4
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
7JOR
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2020-08-07
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
17.2 - 2.050 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.2491 / 0.2880
Structure solution method
_refine.pdbx_method_to_determine_struct
MOLECULAR REPLACEMENT
Starting model (for MR)
_refine.pdbx_starting_model
room temperature x-ray structure