PDBx/mmCIF
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Data Category ma_distance_restraints

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General

Category name
ma_distance_restraints
Required in PDB entries
no
Category group membership
ma_group
Used in current PDB entries
No

Category Relationship Diagrams

70
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Category Description 

               Data items in the MA_DISTANCE_RESTRAINTS category records the
               list of distance restraints used in the modeling.
               These distances can be atomic or residue-wise distances. 
               This has been adapted from the widely used CASP RR format
               (http://www.predictioncenter.org/casp8/index.cgi?page=format#RR).
               These distances may be derived from various coevolution MSA or other
               exeperimental or computational methods.

Category Example

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        loop_
        _ma_distance_restraints.ordinal_id
        _ma_distance_restraints.restraint_id
        _ma_distance_restraints.entity_id_1
        _ma_distance_restraints.asym_id_1
        _ma_distance_restraints.seq_id_1
        _ma_distance_restraints.comp_id_1
        _ma_distance_restraints.atom_id_1
        _ma_distance_restraints.entity_id_2
        _ma_distance_restraints.asym_id_2
        _ma_distance_restraints.seq_id_2
        _ma_distance_restraints.comp_id_2
        _ma_distance_restraints.atom_id_2
        _ma_distance_restraints.upper_limit
        _ma_distance_restraints.upper_limit_esd
        _ma_distance_restraints.restraint_type
        _ma_distance_restraints.granularity
          1  1  3  C   17  LYS  NZ  3  C  421  GLU  OE1  4.8  0.2  'upper bound' 'by-atom'
          2  1  3  C  206  LYS  NZ  3  C  219  ASP  OD1  4.8  0.2  'upper bound' 'by-atom'
          3  1  3  C   38  LYS  NZ  3  C  429  GLU  OE1  4.8  0.2  'upper bound' 'by-atom'
          4  1  3  C  400  LYS  NZ  3  C  440  GLU  OE1  4.8  0.2  'upper bound' 'by-atom'
          5  1  3  C  400  LYS  NZ  3  C  441  GLU  OE1  4.8  0.2  'upper bound' 'by-atom'
          6  1  3  C  400  LYS  NZ  3  C  523  ASP  OD1  4.8  0.2  'upper bound' 'by-atom'
          7  1  3  C  735  LYS  NZ  3  C  403  ASP  OD1  4.8  0.2  'upper bound' 'by-atom'
          8  1  3  C  735  LYS  NZ  3  C  405  GLU  OE1  4.8  0.2  'upper bound' 'by-atom'
          9  1  3  C  865  LYS  NZ  3  C  894  GLU  OE1  4.8  0.2  'upper bound' 'by-atom'
         10  1  3  C  865  LYS  NZ  3  C  898  ASP  OD1  4.8  0.2  'upper bound' 'by-atom'
         11  1  4  D  103  LYS  NZ  4  D  130  ASP  OD1  4.8  0.2  'upper bound' 'by-atom'
         12  1  4  D  103  LYS  NZ  4  D  131  GLU  OE1  4.8  0.2  'upper bound' 'by-atom'
         # ...  abbreviated ...

Key Data Items

Category Data Items

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