Data quality metrics extracted from 6fn5.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 6FN5 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
ROTATING ANODE
Source details
_diffrn_source.type
RIGAKU MICROMAX-007
Temperature [K]
_diffrn.ambient_temp
100
Detector technology
_diffrn_detector.detector
IMAGE PLATE
Collection date
_diffrn_detector.pdbx_collection_date
2009-02-10
Detector
_diffrn_detector.type
MARRESEARCH
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
1.5418
Software
Data reduction
_software.classification
MOSFLM
Data scaling
_software.classification
SCALA (3.2.19)
Phasing
_software.classification
PHENIX
Refinement
_software.classification
PHENIX
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 1 21 1
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
49.425 69.888 59.452 90.00 109.52 90.00
Wavelength
_diffrn_radiation_wavelength.wavelength
1.54180 Å

Data quality metricsOverallInnerShellOuterShell
Low resolution limit [Å] 
_reflns.d_resolution_low _reflns_shell.d_res_low
 27.298 28.595 2.040
High resolution limit [Å] 
_reflns.d_resolution_high _reflns_shell.d_res_high
 1.932 6.110 1.932
Rmerge 
_reflns.pdbx_Rmerge_I_obs _reflns_shell.Rmerge_I_obs
 0.061 0.017 0.525
Rmeas 
_reflns.pdbx_Rrim_I_all _reflns_shell.pdbx_Rrim_I_all
 0.085 0.028 0.726
Rpim 
_reflns.pdbx_Rpim_I_all _reflns_shell.pdbx_Rpim_I_all
 0.052 0.018 0.423
Total number of observations 
_reflns.pdbx_number_measured_all _reflns_shell.number_measured_all
 72769 2159 9067
Total number unique 
_reflns.number_obs _reflns_shell.number_unique_obs
 27188 892 3382
<I/σ(I)> 
_reflns.pdbx_netI_over_sigmaI _reflns_shell.meanI_over_sigI_obs
 8.40 31.80 1.50
Completeness [%] 
_reflns.percent_possible_obs _reflns_shell.percent_possible_all
 94.7 94.7 80.8
Multiplicity 
_reflns.pdbx_redundancy _reflns_shell.pdbx_redundancy
 2.7 2.4 2.7
  CC(1/2) - - -

Refinement
PDB entry ID
_entry.id
6FN5
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2018-02-02
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
23.3 - 1.932 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.2073 / 0.2406
Structure solution method
_refine.pdbx_method_to_determine_struct
MOLECULAR REPLACEMENT
Starting model (for MR)
_refine.pdbx_starting_model
3QYZ