Data quality metrics extracted from 1alj.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 1ALJ at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Detector technology
_diffrn_detector.detector
AREA DETECTOR
Collection date
_diffrn_detector.pdbx_collection_date
1993-05-14
Detector
_diffrn_detector.type
ADSC
Software
Data collection
_software.classification
ADSC
Phasing
_software.classification
X-PLOR
Model building
_software.classification
X-PLOR
Refinement
_software.classification
X-PLOR
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}
194.76 167.74 76.23 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
1.54000 Å

Data quality metricsOverall
Low resolution limit [Å]
_reflns.d_resolution_low
26.300
High resolution limit [Å]
_reflns.d_resolution_high
2.500
Rmerge
_reflns.pdbx_Rmerge_I_obs
0.108
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique
_reflns.number_obs
36882
  <I/σ(I)> -
Completeness [%]
_reflns.percent_possible_obs
98.4
Multiplicity
_reflns.pdbx_redundancy
4.6
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
1ALJ
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
1995-06-02
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
8.0 - 2.600 Å
R
_refine.ls_R_factor_obs
0.1660
Rwork
_refine.ls_R_factor_R_work
0.1660
WARNING: no Rfree given?