Data quality metrics extracted from 1ogs.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 1OGS at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Experimental protocol
_diffrn_radiation.pdbx_diffrn_protocol
MAD
Source type
_diffrn_source.source
SYNCHROTRON
Source details
_diffrn_source.type
ESRF BEAMLINE ID14-4
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
ESRF
Beamline
_diffrn_source.pdbx_synchrotron_beamline
ID14-4
Temperature [K]
_diffrn.ambient_temp
100.0
Collection date
_diffrn_detector.pdbx_collection_date
2003-03-15
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
1.0092, 1.0075, 1.0015, 0.8856
Software
Data reduction
_software.classification
DENZO
Data scaling
_software.classification
SCALEPACK
Phasing
_software.classification
SHARP
Refinement
_software.classification
CNS (1.1)
General information
Spacegroup name
_symmetry.space_group_name_H-M
C 2 2 21
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
107.735 285.232 91.678 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
1.009201.007501.001500.88560 Å

Data quality metricsOverall
Low resolution limit [Å] 
_reflns.d_resolution_low
 10.000
High resolution limit [Å] 
_reflns.d_resolution_high
 2.000
Rmerge 
_reflns.pdbx_Rmerge_I_obs
 0.065
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique 
_reflns.number_obs
 93248
<I/σ(I)> 
_reflns.pdbx_netI_over_sigmaI
 21.60
Completeness [%] 
_reflns.percent_possible_obs
 98.4
Multiplicity 
_reflns.pdbx_redundancy
 10.0
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
1OGS
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2003-05-13
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
14.4 - 2.000 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.1950 / 0.2300
Structure solution method
_refine.pdbx_method_to_determine_struct
MAD