Data quality metrics extracted from 4kpg.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 4KPG at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Source type
_diffrn_source.source
SYNCHROTRON
Source details
_diffrn_source.type
CLSI BEAMLINE 08B1-1
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
CLSI
Beamline
_diffrn_source.pdbx_synchrotron_beamline
08B1-1
Detector technology
_diffrn_detector.detector
CCD
Collection date
_diffrn_detector.pdbx_collection_date
2011-08-15
Detector
_diffrn_detector.type
RAYONIX MX-300
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
0.97895
Software
Data scaling
_software.classification
SCALA (CCP4_3.3.16; 2010/01/06; Phil R. Evans; pre@mrc-lmb.cam.ac.uk)
Refinement
_software.classification
PHENIX (1.7.2_869; Paul D. Adams; PDAdams@lbl.gov)
General information
Spacegroup name
_symmetry.space_group_name_H-M
I 2 2 2
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
81.00 94.08 119.60 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
0.97895 Å

Data quality metricsOverall
Low resolution limit [Å]
_reflns.d_resolution_low
59.930
High resolution limit [Å]
_reflns.d_resolution_high
2.148
  Rmerge -
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique
_reflns.number_obs
25383
  <I/σ(I)> -
Completeness [%]
_reflns.percent_possible_obs
99.8
  Multiplicity -
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
4KPG
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2013-05-13
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
47.0 - 2.148 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.1660 / 0.1967
Structure solution method
_refine.pdbx_method_to_determine_struct
SAD