Data quality metrics extracted from 1ce1.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 1CE1 at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Experimental protocol
_diffrn_radiation.pdbx_diffrn_protocol
SINGLE WAVELENGTH
Temperature [K]
_diffrn.ambient_temp
100
Collection date
_diffrn_detector.pdbx_collection_date
1998-02
Software
Phasing
_software.classification
AMoRE
Refinement
_software.classification
REFMAC
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 21 21 21
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
54.846 60.672 152.908 90.00 89.72 89.85
Wavelength
_diffrn_radiation_wavelength.wavelength
1.54180 Å

Data quality metricsOverall
Low resolution limit [Å] 
_reflns.d_resolution_low
 40.000
High resolution limit [Å] 
_reflns.d_resolution_high
 1.900
Rmerge 
_reflns.pdbx_Rmerge_I_obs
 0.054
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique 
_reflns.number_obs
 40254
  <I/σ(I)> -
Completeness [%] 
_reflns.percent_possible_obs
 98.8
Multiplicity 
_reflns.pdbx_redundancy
 3.0
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
1CE1
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
1999-03-12
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
6.0 - 1.900 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.2200 / 0.2700
Structure solution method
_refine.pdbx_method_to_determine_struct
MOLECULAR REPLACEMENT
Starting model (for MR)
_refine.pdbx_starting_model
WARNING: no starting model (for MR) given