Data quality metrics extracted from 1a5c.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 1A5C at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Source type
_diffrn_source.source
SYNCHROTRON
Source details
_diffrn_source.type
ESRF BEAMLINE BM02
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
ESRF
Beamline
_diffrn_source.pdbx_synchrotron_beamline
BM02
Temperature [K]
_diffrn.ambient_temp
100
Collection date
_diffrn_detector.pdbx_collection_date
1996-10-26
Software
Data reduction
_software.classification
XDS
Data scaling
_software.classification
XDS
Phasing
_software.classification
X-PLOR (3.0)
Model building
_software.classification
X-PLOR (3.0)
Refinement
_software.classification
X-PLOR (3.0)
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 32 2 1
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
119.2 119.2 132.3 90.0 90.0 120.0
Wavelength
_diffrn_radiation_wavelength.wavelength
0.90000 Å

Data quality metricsOverall
Low resolution limit [Å]
_reflns.d_resolution_low
100.000
High resolution limit [Å]
_reflns.d_resolution_high
3.000
Rmerge
_reflns.pdbx_Rsym_value
0.077
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique
_reflns.number_obs
20677
<I/σ(I)>
_reflns.pdbx_netI_over_sigmaI
8.20
Completeness [%]
_reflns.percent_possible_obs
94.0
  Multiplicity -
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
1A5C
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
1998-02-13
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
8.0 - 3.000 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.2390 / 0.3290
Structure solution method
_refine.pdbx_method_to_determine_struct
MOLECULAR REPLACEMENT
Starting model (for MR)
_refine.pdbx_starting_model
PDB ENTRY 1FBA