Data quality metrics extracted from 1fqy.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 1FQY at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
ELECTRON CRYSTALLOGRAPHY
Experimental protocol
_diffrn_radiation.pdbx_diffrn_protocol
SINGLE WAVELENGTH
Source type
_diffrn_source.source
ELECTRON MICROSCOPE
Source details
_diffrn_source.type
JEOL 3000 SFF
Temperature [K]
_diffrn.ambient_temp
4.0
Detector technology
_diffrn_detector.detector
CCD
Collection date
_diffrn_detector.pdbx_collection_date
1996-06-07
Detector
_diffrn_detector.type
GATAN Model 795 MegaScan
Software
Data scaling
_software.classification
CCP4 (TRUNCATE)
Phasing
_software.classification
LATLINE
Model building
_software.classification
LATLINE
Refinement
_software.classification
X-PLOR (3.851)
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 4 21 2
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
96.0 96.0 100.0 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
0.01970 Å

Data quality metricsOverallOuterShell
Low resolution limit [Å]
_reflns.d_resolution_low _reflns_shell.d_res_low
96.000 3.900
High resolution limit [Å]
_reflns.d_resolution_high _reflns_shell.d_res_high
3.800 3.800
Rmerge
_reflns.pdbx_Rmerge_I_obs _reflns_shell.Rmerge_I_obs
0.495 0.703
  Rmeas - -
  Rpim - -
  Total number of observations - -
Total number unique
_reflns.number_obs _reflns_shell.number_unique_all
85254 4010
<I/σ(I)>
_reflns.pdbx_netI_over_sigmaI
1.10 -
Completeness [%]
_reflns.percent_possible_obs _reflns_shell.percent_possible_all
88.0 86.9
Multiplicity
_reflns.pdbx_redundancy _reflns_shell.pdbx_redundancy
18.8 13.2
  CC(1/2) - -

Refinement
PDB entry ID
_entry.id
1FQY
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2000-09-07
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
6.0 - 3.800 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.3990 / 0.4170