Data quality metrics extracted from 1b8e.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 1B8E 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
LNLS BEAMLINE D03B-MX1
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
LNLS
Beamline
_diffrn_source.pdbx_synchrotron_beamline
D03B-MX1
Temperature [K]
_diffrn.ambient_temp
291
Detector technology
_diffrn_detector.detector
IMAGE PLATE
Collection date
_diffrn_detector.pdbx_collection_date
1997-09
Detector
_diffrn_detector.type
MARRESEARCH
Software
Data reduction
_software.classification
DENZO
Data scaling
_software.classification
SCALEPACK
Phasing
_software.classification
AMoRE
Refinement
_software.classification
REFMAC
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}
55.64 81.65 66.86 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
1.38000 Å

Data quality metricsOverall
Low resolution limit [Å]
_reflns.d_resolution_low
14.980
High resolution limit [Å]
_reflns.d_resolution_high
1.950
Rmerge
_reflns.pdbx_Rsym_value
0.085
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique
_reflns.number_obs
9834
<I/σ(I)>
_reflns.pdbx_netI_over_sigmaI
9.20
Completeness [%]
_reflns.percent_possible_obs
86.4
Multiplicity
_reflns.pdbx_redundancy
3.0
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
1B8E
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
1999-01-30
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
9.5 - 1.950 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.1890 / 0.2520
Structure solution method
_refine.pdbx_method_to_determine_struct
MOLECULAR REPLACEMENT
Starting model (for MR)
_refine.pdbx_starting_model
B-LG LATTICE Y FROM MIXTURE OF GENETIC VARIANTS A AND B