Data quality metrics extracted from 1nno.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 1NNO 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
100
Detector technology
_diffrn_detector.detector
IMAGE PLATE
Collection date
_diffrn_detector.pdbx_collection_date
1996-12
Detector
_diffrn_detector.type
MARRESEARCH
Software
Data reduction #1
_software.classification
DENZO
Data reduction #2
_software.classification
PROW
Data scaling
_software.classification
SCALEPACK
Phasing
_software.classification
X-PLOR (3.843)
Model building
_software.classification
X-PLOR (3.843)
Refinement
_software.classification
X-PLOR (3.843)
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 21 21 2
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
166.072 88.110 113.981 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
0.90700 Å

Data quality metricsOverall
Low resolution limit [Å]
_reflns.d_resolution_low
15.000
High resolution limit [Å]
_reflns.d_resolution_high
2.650
Rmerge
_reflns.pdbx_Rmerge_I_obs
0.069
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique
_reflns.number_obs
44045
<I/σ(I)>
_reflns.pdbx_netI_over_sigmaI
10.30
Completeness [%]
_reflns.percent_possible_obs
90.7
Multiplicity
_reflns.pdbx_redundancy
3.0
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
1NNO
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
1998-07-20
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
15.0 - 2.650 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.2090 / 0.2430
Structure solution method
_refine.pdbx_method_to_determine_struct
OTHER