Data quality metrics extracted from 3ve4.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 3VE4 at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Experimental protocol
_diffrn_radiation.pdbx_diffrn_protocol
LAUE
Source type
_diffrn_source.source
SYNCHROTRON
Source details
_diffrn_source.type
ESRF BEAMLINE ID09
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
ESRF
Beamline
_diffrn_source.pdbx_synchrotron_beamline
ID09
Temperature [K]
_diffrn.ambient_temp
288.0
Detector technology
_diffrn_detector.detector
CCD
Collection date
_diffrn_detector.pdbx_collection_date
2005-10-15
Detector
_diffrn_detector.type
MAR CCD 130 mm
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
0.77-1.24
Software
Data reduction #1
_software.classification
XFIT
Data reduction #2
_software.classification
LaueView
Data scaling
_software.classification
LaueView
Refinement
_software.classification
SHELXL-97
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 63
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
66.833 66.833 40.947 90.0 90.0 120.0
Wavelength
_diffrn_radiation_wavelength.wavelength
0.770001.24000 Å

Data quality metricsOverall
Low resolution limit [Å]
_reflns.d_resolution_low
28.900
High resolution limit [Å]
_reflns.d_resolution_high
1.600
  Rmerge -
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique
_reflns.number_obs
13891
  <I/σ(I)> -
  Completeness [%] -
  Multiplicity -
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
3VE4
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2012-01-07
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
28.9 - 1.600 Å
R
_refine.ls_R_factor_obs
0.2140
WARNING: no Rwork given
Rfree
_refine.ls_R_factor_R_free
0.2520