Data quality metrics extracted from 2acv.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 2ACV 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
CAMD BEAMLINE GCPCC
Synchrotron site
_diffrn_source.pdbx_synchrotron_site
CAMD
Beamline
_diffrn_source.pdbx_synchrotron_beamline
GCPCC
Temperature [K]
_diffrn.ambient_temp
93
Detector technology
_diffrn_detector.detector
CCD
Collection date
_diffrn_detector.pdbx_collection_date
2005-02-09
Detector
_diffrn_detector.type
MARRESEARCH
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
0.9797, 0.97996, 0.9393
Software
Data reduction #1
_software.classification
HKL-2000
Data reduction #2
_software.classification
DENZO
Data scaling #1
_software.classification
HKL-2000
Data scaling #2
_software.classification
SCALEPACK
Phasing
_software.classification
SOLVE
Refinement
_software.classification
CNS (Axel T. Brunger; axel.brunger@yale.edu)
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 1 21 1
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
53.713 90.593 101.788 90.000 102.567 90.000
Wavelength
_diffrn_radiation_wavelength.wavelength
1.541800.979700.979960.93930 Å

Data quality metricsOverall
Low resolution limit [Å] 
_reflns.d_resolution_low
 100.000
High resolution limit [Å] 
_reflns.d_resolution_high
 2.000
Rmerge 
_reflns.pdbx_Rmerge_I_obs
 0.041
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique 
_reflns.number_obs
 62825
<I/σ(I)> 
_reflns.pdbx_netI_over_sigmaI
 13.70
Completeness [%] 
_reflns.percent_possible_obs
 98.2
  Multiplicity -
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
2ACV
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2005-07-19
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
66.9 - 2.000 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.1870 / 0.2290
Structure solution method
_refine.pdbx_method_to_determine_struct
MAD