Data quality metrics extracted from 1gbu.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 1GBU 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
1994-11-20
Detector
_diffrn_detector.type
SIEMENS
Software
Data reduction
_software.classification
XENGEN
Refinement #1
_software.classification
PROLSQ
Refinement #2
_software.classification
GPRLSA
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}
63.02 82.94 53.83 90.00 99.16 90.00
Wavelength
_diffrn_radiation_wavelength.wavelength
1.54180 Å

Data quality metricsOverall
Low resolution limit [Å]
_reflns.d_resolution_low
6.000
High resolution limit [Å]
_reflns.d_resolution_high
1.800
Rmerge
_reflns.pdbx_Rsym_value
0.080
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique
_reflns.number_obs
41926
<I/σ(I)>
_reflns.pdbx_netI_over_sigmaI
1.10
Completeness [%]
_reflns.percent_possible_obs
82.7
Multiplicity
_reflns.pdbx_redundancy
3.1
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
1GBU
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
1996-01-04
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
6.0 - 1.800 Å
Rwork
_refine.ls_R_factor_R_work
0.1670
WARNING: no Rfree given (but Rwork)!?