Data quality metrics extracted from 1rhy.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 1RHY 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
ESRF BEAMLINE BM14
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
ESRF
Beamline
_diffrn_source.pdbx_synchrotron_beamline
BM14
Temperature [K]
_diffrn.ambient_temp
100
Detector technology
_diffrn_detector.detector
IMAGE PLATE
Collection date
_diffrn_detector.pdbx_collection_date
1997-09-15
Detector
_diffrn_detector.type
MARRESEARCH
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
1.0086, 1.0078, 0.9150
Software
Data reduction
_software.classification
XDS
Data scaling #1
_software.classification
XDS
Data scaling #2
_software.classification
SCALEPACK
Phasing #1
_software.classification
SOLVE
Phasing #2
_software.classification
DM
Model building
_software.classification
DM
Refinement
_software.classification
CNS (1.0)
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 21 3
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
105.275 105.275 105.275 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
1.008601.007800.91500 Å

Data quality metricsOverall
Low resolution limit [Å] 
_reflns.d_resolution_low
 20.000
High resolution limit [Å] 
_reflns.d_resolution_high
 2.300
Rmerge 
_reflns.pdbx_Rsym_value
 0.066
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique 
_reflns.number_obs
 17324
<I/σ(I)> 
_reflns.pdbx_netI_over_sigmaI
 17.80
Completeness [%] 
_reflns.percent_possible_obs
 98.7
Multiplicity 
_reflns.pdbx_redundancy
 10.0
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
1RHY
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2003-11-14
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
19.6 - 2.300 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.1890 / 0.2280
Structure solution method
_refine.pdbx_method_to_determine_struct
MAD