PDBx/mmCIF
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Data Category pdbx_ligscreen_investigation_series

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General

Category name
pdbx_ligscreen_investigation_series
Required in PDB entries
no
Category group membership
ligscreen_group
Used in current PDB entries
No

Category Relationship Diagrams

70
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Category Description 

               The PDBX_LIGSCREEN_INVESTIGATION_SERIES category contains data pertinent to common sets (series)
               of experiments within an investigation. If a named fragments screen was used, it is captured here.
               Multiple experimental series could exist for a fragment screening investigation campaign.

Category Examples

2

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Category Example1

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_pdbx_ligscreen_investigation_series.series_id                     1
_pdbx_ligscreen_investigation_series.campaign_id                   1
_pdbx_ligscreen_investigation_series.investigation_id              FH123
_pdbx_ligscreen_investigation_series.type_of_library               FRAGLIB
_pdbx_ligscreen_investigation_series.library                       EUOPEN-EFSL
_pdbx_ligscreen_investigation_series.library_batch                 ?
_pdbx_ligscreen_investigation_series.lib_identification_method     manual_curation
_pdbx_ligscreen_investigation_series.lib_details                   ?

Category Example2

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loop_
_pdbx_ligscreen_investigation_series.series_id 
_pdbx_ligscreen_investigation_series.campaign_id 
_pdbx_ligscreen_investigation_series.investigation_id 
_pdbx_ligscreen_investigation_series.type_of_library
_pdbx_ligscreen_investigation_series.library 
_pdbx_ligscreen_investigation_series.library_batch 
_pdbx_ligscreen_investigation_series.lib_identification_method
_pdbx_ligscreen_investigation_series.lib_details 

1  1  FH123     FRAGLIB    SpotXplorer       ?    facility_curation   'Chemical library was purchased and received in 2015.' 
2  1  FH123     FRAGLIB    Fraglites         ?    facility_curation   'Chemical library was purchased and received in 2022.' 
3  1  FH123     FRAGLIB    Other-Fraglib     v1.1 author              'Fragment library designed by analysis of previous hits'
4  2  FH123     FRAGLIB    FragMAXlib        ?    facility_curation   ?
5  2  FH123     SAR        Other             ?    unknown             ?

Key Data Items

Category Data Items

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