Data quality metrics extracted from 4w1y.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 4W1Y at RCSB, PDBe, PDBj

Experiment
Method
_exptl.method
X-RAY DIFFRACTION
Experimental protocol
_diffrn_radiation.pdbx_diffrn_protocol
SINGLE WAVELENGTH
Source type
_diffrn_source.source
ROTATING ANODE
Source details
_diffrn_source.type
RIGAKU RUH3R
Temperature [K]
_diffrn.ambient_temp
100
Detector technology
_diffrn_detector.detector
IMAGE PLATE
Collection date
_diffrn_detector.pdbx_collection_date
2005-08-01
Detector
_diffrn_detector.type
MAR scanner 345 mm plate
Wavelength(s) [Å]
_diffrn_source.pdbx_wavelength_list
1.54
Software
Refinement
_software.classification
REFMAC (5.4.0077)
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 43 21 2
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
109.971 109.971 238.403 90.0 90.0 90.0
Wavelength
_diffrn_radiation_wavelength.wavelength
1.54000 Å

Data quality metricsOverall
Low resolution limit [Å]
_reflns.d_resolution_low
15.000
High resolution limit [Å]
_reflns.d_resolution_high
3.200
Rmerge
_reflns.pdbx_Rsym_value
0.124
  Rmeas -
  Rpim -
  Total number of observations -
Total number unique
_reflns.number_obs
22389
<I/σ(I)>
_reflns.pdbx_netI_over_sigmaI
19.20
Completeness [%]
_reflns.percent_possible_obs
94.8
Multiplicity
_reflns.pdbx_redundancy
5.9
  CC(1/2) -

Refinement
PDB entry ID
_entry.id
4W1Y
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2014-08-13
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
15.0 - 3.200 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.2138 / 0.2897