Data quality metrics extracted from 4p6b.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 4P6B at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Experimental protocol
_diffrn_radiation.pdbx_diffrn_protocol
MAD
Source type
_diffrn_source.source
SYNCHROTRON
Source details
_diffrn_source.type
PAL/PLS BEAMLINE 4A
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
PAL/PLS
Beamline
_diffrn_source.pdbx_synchrotron_beamline
4A
Temperature [K]
_diffrn.ambient_temp
100
Detector technology
_diffrn_detector.detector
CCD
Collection date
_diffrn_detector.pdbx_collection_date
2009-03-08
Detector
_diffrn_detector.type
ADSC QUANTUM 315
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
1.00000, 0.97888, 0.97917, 0.96395
Software
Data scaling
_software.classification
HKL-2000
Refinement #1
_software.classification
REFMAC (5.5.0109)
Refinement #2
_software.classification
PHENIX
General information
Spacegroup name
_symmetry.space_group_name_H-M
I 4
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
121.541 121.541 155.173 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
1.000000.978880.979170.96395 Å

Data quality metricsOverall
Low resolution limit [Å] 
_reflns.d_resolution_low
 50.000
High resolution limit [Å] 
_reflns.d_resolution_high
 1.700
  Rmerge -
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique 
_reflns.number_obs
 122542
<I/σ(I)> 
_reflns.pdbx_netI_over_sigmaI
 45.00
Completeness [%] 
_reflns.percent_possible_obs
 99.5
Multiplicity 
_reflns.pdbx_redundancy
 7.2
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
4P6B
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2014-03-24
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
30.0 - 1.700 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.1704 / 0.1879