Data quality metrics extracted from 1o3r.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 1O3R at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Experimental protocol
_diffrn_radiation.pdbx_diffrn_protocol
SINGLE WAVELENGTH
Source type
_diffrn_source.source
SYNCHROTRON
Source details
_diffrn_source.type
NSLS BEAMLINE X25
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
NSLS
Beamline
_diffrn_source.pdbx_synchrotron_beamline
X25
Temperature [K]
_diffrn.ambient_temp
108.0
Detector technology
_diffrn_detector.detector
IMAGE PLATE
Collection date
_diffrn_detector.pdbx_collection_date
1997-09-01
Detector
_diffrn_detector.type
RIGAKU RAXIS
Software
Data reduction
_software.classification
DENZO
Data scaling #1
_software.classification
SCALA
Data scaling #2
_software.classification
CCP4 (SCALA)
Phasing
_software.classification
AMoRE
Refinement
_software.classification
CNS (0.5)
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}
76.90 76.90 143.64 90.0 90.0 120.0
Wavelength
_diffrn_radiation_wavelength.wavelength
1.10000 Å

Data quality metricsOverall
Low resolution limit [Å]
_reflns.d_resolution_low
20.000
High resolution limit [Å]
_reflns.d_resolution_high
3.000
Rmerge
_reflns.pdbx_Rmerge_I_obs
0.057
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique
_reflns.number_obs
9519
<I/σ(I)>
_reflns.pdbx_netI_over_sigmaI
10.80
Completeness [%]
_reflns.percent_possible_obs
92.5
Multiplicity
_reflns.pdbx_redundancy
5.3
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
1O3R
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2003-03-18
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
20.0 - 3.000 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.2330 / 0.2830