Data quality metrics extracted from 2pps.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 2PPS at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Source type
_diffrn_source.source
SYNCHROTRON
Source details
_diffrn_source.type
EMBL/DESY, HAMBURG BEAMLINE X11
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
EMBL/DESY, HAMBURG
Beamline
_diffrn_source.pdbx_synchrotron_beamline
X11
Temperature [K]
_diffrn.ambient_temp
279
Detector technology
_diffrn_detector.detector
IMAGE PLATE
Collection date
_diffrn_detector.pdbx_collection_date
1993-07
Detector
_diffrn_detector.type
MARRESEARCH
Software
Data reduction
_software.classification
MOSFLM
Data scaling #1
_software.classification
CCP4 (AGROVATA
Data scaling #2
_software.classification
ROTAVATA
Phasing
_software.classification
MLPHARE
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}
286.0 286.0 167.0 90.0 90.0 120.0
Wavelength
_diffrn_radiation_wavelength.wavelength
0.92000 Å

Data quality metricsOverallOuterShell
Low resolution limit [Å]
_reflns.d_resolution_low _reflns_shell.d_res_low
34.900 3.950
High resolution limit [Å]
_reflns.d_resolution_high _reflns_shell.d_res_high
3.850 3.850
Rmerge
_reflns.pdbx_Rmerge_I_obs _reflns_shell.pdbx_Rsym_value
0.085 0.173
  Rmeas - -
  Rpim - -
  Total number of observations - -
Total number unique
_reflns.number_obs
69153 -
<I/σ(I)>
_reflns.pdbx_netI_over_sigmaI _reflns_shell.meanI_over_sigI_obs
6.40 3.60
Completeness [%]
_reflns.percent_possible_obs _reflns_shell.percent_possible_all
94.4 81.3
Multiplicity
_reflns.pdbx_redundancy _reflns_shell.pdbx_redundancy
2.8 2.0
  CC(1/2) - -

Refinement
PDB entry ID
_entry.id
2PPS
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
1997-05-27
Structure solution method
_refine.pdbx_method_to_determine_struct
MULTIPLE ISOMORPHOUS REPLACEMENT