Data quality metrics extracted from 2i54.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 2I54 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
APS BEAMLINE 14-ID-B
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
APS
Beamline
_diffrn_source.pdbx_synchrotron_beamline
14-ID-B
Collection date
_diffrn_detector.pdbx_collection_date
2005-04-06
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
0.979417, 0.979564, 0.984011
Software
Data collection
_software.classification
HKL-2000
Data reduction
_software.classification
HKL-2000
Data scaling
_software.classification
HKL-2000
Phasing
_software.classification
SHARP
Refinement
_software.classification
REFMAC (5.2.0005; Murshudov, G.N.; ccp4@dl.ac.uk)
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 31 2 1
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
92.413 92.413 173.249 90.0 90.0 120.0
Wavelength
_diffrn_radiation_wavelength.wavelength
0.979420.979560.98401 Å

Data quality metricsOverall
Low resolution limit [Å] 
_reflns.d_resolution_low
 30.000
High resolution limit [Å] 
_reflns.d_resolution_high
 2.100
  Rmerge -
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique 
_reflns.number_obs
 50609
  <I/σ(I)> -
Completeness [%] 
_reflns.percent_possible_obs
 99.8
  Multiplicity -
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
2I54
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2006-08-24
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
29.8 - 2.100 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.1890 / 0.2300
Structure solution method
_refine.pdbx_method_to_determine_struct
MAD