Data quality metrics extracted from 1h9a.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 1H9A 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 RU200
Temperature [K]
_diffrn.ambient_temp
293.0
Detector technology
_diffrn_detector.detector
IMAGE PLATE
Collection date
_diffrn_detector.pdbx_collection_date
1994-11-15
Detector
_diffrn_detector.type
MARRESEARCH
Software
Data reduction
_software.classification
DENZO
Data scaling
_software.classification
SCALEPACK
Phasing
_software.classification
X-PLOR (3.1)
Refinement
_software.classification
X-PLOR (3.851)
General information
Spacegroup name
_symmetry.space_group_name_H-M
P 62 2 2
Unit cell parameters
_cell.length_{a,b,c} _cell.angle_{alpha,beta,gamma}
136.7 136.7 121.2 90.0 90.0 120.0
Wavelength
_diffrn_radiation_wavelength.wavelength
1.54200 Å

Data quality metricsOverallOuterShell
Low resolution limit [Å]
_reflns.d_resolution_low _reflns_shell.d_res_low
25.000 2.240
High resolution limit [Å]
_reflns.d_resolution_high _reflns_shell.d_res_high
2.160 2.160
Rmerge
_reflns.pdbx_Rsym_value _reflns_shell.pdbx_Rsym_value
0.138 0.506
  Rmeas - -
  Rpim - -
  Total number of observations - -
Total number unique
_reflns.number_obs
32868 -
<I/σ(I)>
_reflns.pdbx_netI_over_sigmaI _reflns_shell.meanI_over_sigI_obs
8.10 1.80
Completeness [%]
_reflns.percent_possible_obs _reflns_shell.percent_possible_all
90.2 81.3
Multiplicity
_reflns.pdbx_redundancy _reflns_shell.pdbx_redundancy
2.8 2.5
  CC(1/2) - -

Refinement
PDB entry ID
_entry.id
1H9A
Deposition date
_pdbx_database_status.recvd_initial_deposition_date
2001-03-06
Resolution
_refine.ls_d_res_low _refine.ls_d_res_high
21.2 - 2.160 Å
Rwork/Rfree
_refine.ls_R_factor_R_work _refine.ls_R_factor_R_free
0.1870 / 0.2260
Structure solution method
_refine.pdbx_method_to_determine_struct
MOLECULAR REPLACEMENT
Starting model (for MR)
_refine.pdbx_starting_model
SUBUNIT 'A' OF 1DPG