Data quality metrics extracted from 1ts2.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 1TS2 at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Source type
_diffrn_source.source
ROTATING ANODE
Source details
_diffrn_source.type
RIGAKU RUH2R
Temperature [K]
_diffrn.ambient_temp
293
Detector technology
_diffrn_detector.detector
AREA DETECTOR
Collection date
_diffrn_detector.pdbx_collection_date
1997-06
Detector
_diffrn_detector.type
SIEMENS
Software
Data reduction
_software.classification
XENGEN
Data scaling
_software.classification
XENGEN
Phasing
_software.classification
X-PLOR (3.8)
Model building
_software.classification
X-PLOR (3.8)
Refinement
_software.classification
X-PLOR (3.8)
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}
108.84 177.40 97.22 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
1.54180 Å

Data quality metricsOverallOuterShell
Low resolution limit [Å] 
_reflns.d_resolution_low _reflns_shell.d_res_low
 20.000 2.400
High resolution limit [Å] 
_reflns.d_resolution_high _reflns_shell.d_res_high
 2.300 2.300
Rmerge 
_reflns.pdbx_Rsym_value _reflns_shell.pdbx_Rsym_value
 0.096 0.359
  Rmeas - -
  Rpim - -
  Total number of observations - -
Total number unique 
_reflns.number_obs
 38992 -
<I/σ(I)> 
_reflns.pdbx_netI_over_sigmaI _reflns_shell.meanI_over_sigI_obs
 6.70 1.20
Completeness [%] 
_reflns.percent_possible_obs _reflns_shell.percent_possible_all
 91.0 51.0
Multiplicity 
_reflns.pdbx_redundancy _reflns_shell.pdbx_redundancy
 11.3 3.3
  CC(1/2) - -

Refinement
PDB entry ID
_entry.id
1TS2
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
1997-10-09
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
20.0 - 2.300 Å